Product OPENEYE NAME: (2,4-dinitrophenyl)methanol
CAS Name: (2,4-dinitrophenyl)methanol
IUPAC NAME: (2,4-dinitrophenyl)methanol
SYSTEMATIC NAME: (2,4-dinitrophenyl)methanol
MOLECULAR FORMULA: C7H6N2O5
MOLECULAR WEIGHT: 198.13294
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CO
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Product OPENEYE NAME: 3,4-dihydro-1H-isoquinolin-2-amine
CAS Name: 3,4-dihydro-1H-isoquinolin-2-amine
IUPAC NAME: 3,4-dihydro-1H-isoquinolin-2-amine
SYSTEMATIC NAME: 3,4-dihydro-1H-isoquinolin-2-amine
MOLECULAR FORMULA: C9H12N2
MOLECULAR WEIGHT: 148.20498
SMILES: C1CN(CC2=CC=CC=C21)N
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Product OPENEYE NAME: 1-(diaminomethylene)-2-hexyl-guanidine
CAS Name: 1-(diaminomethylidene)-2-hexylguanidine
IUPAC NAME: 1-(diaminomethylidene)-2-hexylguanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-hexyl-guanidine
MOLECULAR FORMULA: C8H19N5
MOLECULAR WEIGHT: 185.26996
SMILES: CCCCCCN=C(N)N=C(N)N
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Product OPENEYE NAME: [N'-[4-(butylcarbamoyl)phenyl]carbamimidoyl]-carbamimidoyl-ammonium chloride
CAS Name: [amino-[4-[butylamino(oxo)methyl]phenyl]iminomethyl]-carbamimidoylammonium chloride
IUPAC NAME: [N'-[4-(butylcarbamoyl)phenyl]carbamimidoyl]-carbamimidoylazanium chloride
SYSTEMATIC NAME: [N'-[4-(butylcarbamoyl)phenyl]carbamimidoyl]-carbamimidoyl-azanium chloride
MOLECULAR FORMULA: C13H21ClN6O
MOLECULAR WEIGHT: 312.79844
SMILES: CCCCNC(=O)C1=CC=C(C=C1)N=C(N)[NH2+]C(=N)N.[Cl-]
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Product OPENEYE NAME: 4-[[amino(guanidino)methylene]amino]-N-butyl-benzamide
CAS Name: 4-[[amino-(diaminomethylideneamino)methylidene]amino]-N-butylbenzamide
IUPAC NAME: 4-[[amino-(diaminomethylideneamino)methylidene]amino]-N-butylbenzamide
SYSTEMATIC NAME: 4-[[azanyl-[bis(azanyl)methylideneamino]methylidene]amino]-N-butyl-benzamide
MOLECULAR FORMULA: C13H20N6O
MOLECULAR WEIGHT: 276.3375
SMILES: CCCCNC(=O)C1=CC=C(C=C1)N=C(N)N=C(N)N
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Product OPENEYE NAME: carbamimidoyl-[N'-[4-(dibutylcarbamoyl)phenyl]carbamimidoyl]ammonium chloride
CAS Name: [amino-[4-[(dibutylamino)-oxomethyl]phenyl]iminomethyl]-carbamimidoylammonium chloride
IUPAC NAME: carbamimidoyl-[N'-[4-(dibutylcarbamoyl)phenyl]carbamimidoyl]azanium chloride
SYSTEMATIC NAME: carbamimidoyl-[N'-[4-(dibutylcarbamoyl)phenyl]carbamimidoyl]azanium chloride
MOLECULAR FORMULA: C17H29ClN6O
MOLECULAR WEIGHT: 368.90476
SMILES: CCCCN(CCCC)C(=O)C1=CC=C(C=C1)N=C(N)[NH2+]C(=N)N.[Cl-]
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Product OPENEYE NAME: 4-[[amino(guanidino)methylene]amino]-N,N-dibutyl-benzamide
CAS Name: 4-[[amino-(diaminomethylideneamino)methylidene]amino]-N,N-dibutylbenzamide
IUPAC NAME: 4-[[amino-(diaminomethylideneamino)methylidene]amino]-N,N-dibutylbenzamide
SYSTEMATIC NAME: 4-[[azanyl-[bis(azanyl)methylideneamino]methylidene]amino]-N,N-dibutyl-benzamide
MOLECULAR FORMULA: C17H28N6O
MOLECULAR WEIGHT: 332.44382
SMILES: CCCCN(CCCC)C(=O)C1=CC=C(C=C1)N=C(N)N=C(N)N
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Product OPENEYE NAME: 1-(diaminomethylene)-2-(4-methoxyphenyl)guanidine
CAS Name: 1-(diaminomethylidene)-2-(4-methoxyphenyl)guanidine
IUPAC NAME: 1-(diaminomethylidene)-2-(4-methoxyphenyl)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-(4-methoxyphenyl)guanidine
MOLECULAR FORMULA: C9H13N5O
MOLECULAR WEIGHT: 207.23242
SMILES: COC1=CC=C(C=C1)N=C(N)N=C(N)N
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Product OPENEYE NAME: 3,3-dimethylpentanedioic acid
CAS Name: 3,3-dimethylpentanedioic acid
IUPAC NAME: 3,3-dimethylpentanedioic acid
SYSTEMATIC NAME: 3,3-dimethylpentanedioic acid
MOLECULAR FORMULA: C7H12O4
MOLECULAR WEIGHT: 160.16778
SMILES: CC(C)(CC(=O)O)CC(=O)O
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Product OPENEYE NAME: vinyl cyclohexanecarboxylate
CAS Name: cyclohexanecarboxylic acid ethenyl ester
IUPAC NAME: ethenyl cyclohexanecarboxylate
SYSTEMATIC NAME: ethenyl cyclohexanecarboxylate
MOLECULAR FORMULA: C9H14O2
MOLECULAR WEIGHT: 154.20626
SMILES: C=COC(=O)C1CCCCC1
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Product OPENEYE NAME: bicyclo[3.3.1]non-3-en-9-one
CAS Name: 9-bicyclo[3.3.1]non-3-enone
IUPAC NAME: bicyclo[3.3.1]non-3-en-9-one
SYSTEMATIC NAME: bicyclo[3.3.1]non-3-en-9-one
MOLECULAR FORMULA: C9H12O
MOLECULAR WEIGHT: 136.19098
SMILES: C1CC2CC=CC(C1)C2=O
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Product OPENEYE NAME: N-methyl-N-(4-phenylazophenyl)formamide
CAS Name: N-methyl-N-(4-phenyldiazenylphenyl)formamide
IUPAC NAME: N-methyl-N-(4-phenyldiazenylphenyl)formamide
SYSTEMATIC NAME: N-methyl-N-(4-phenyldiazenylphenyl)methanamide
MOLECULAR FORMULA: C14H13N3O
MOLECULAR WEIGHT: 239.27252
SMILES: CN(C=O)C1=CC=C(C=C1)N=NC2=CC=CC=C2
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Product OPENEYE NAME: (1-methyl-4-piperidyl) 4-(butylamino)-2-chloro-benzoate
CAS Name: 4-(butylamino)-2-chlorobenzoic acid (1-methyl-4-piperidinyl) ester
IUPAC NAME: (1-methylpiperidin-4-yl) 4-(butylamino)-2-chlorobenzoate
SYSTEMATIC NAME: (1-methylpiperidin-4-yl) 4-(butylamino)-2-chloranyl-benzoate
MOLECULAR FORMULA: C17H25ClN2O2
MOLECULAR WEIGHT: 324.8456
SMILES: CCCCNC1=CC(=C(C=C1)C(=O)OC2CCN(CC2)C)Cl
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Product OPENEYE NAME: tert-butyl N-[3-(dimethylcarbamoylamino)phenyl]carbamate
CAS Name: N-[3-[[dimethylamino(oxo)methyl]amino]phenyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[3-(dimethylcarbamoylamino)phenyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[3-(dimethylcarbamoylamino)phenyl]carbamate
MOLECULAR FORMULA: C14H21N3O3
MOLECULAR WEIGHT: 279.33484
SMILES: CC(C)(C)OC(=O)NC1=CC=CC(=C1)NC(=O)N(C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24N2
MOLECULAR WEIGHT: 292.41796
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3CC4=CC=CC=C24
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Product OPENEYE NAME: 1-[6-(2,5-dioxopyrrol-1-yl)hexyl]pyrrole-2,5-dione
CAS Name: 1-[6-(2,5-dioxo-1-pyrrolyl)hexyl]pyrrole-2,5-dione
IUPAC NAME: 1-[6-(2,5-dioxopyrrol-1-yl)hexyl]pyrrole-2,5-dione
SYSTEMATIC NAME: 1-[6-[2,5-bis(oxidanylidene)pyrrol-1-yl]hexyl]pyrrole-2,5-dione
MOLECULAR FORMULA: C14H16N2O4
MOLECULAR WEIGHT: 276.28784
SMILES: C1=CC(=O)N(C1=O)CCCCCCN2C(=O)C=CC2=O
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Product OPENEYE NAME: 1-chlorohexadecane
CAS Name: 1-chlorohexadecane
IUPAC NAME: 1-chlorohexadecane
SYSTEMATIC NAME: 1-chloranylhexadecane
MOLECULAR FORMULA: C16H33Cl
MOLECULAR WEIGHT: 260.88622
SMILES: CCCCCCCCCCCCCCCCCl
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Product OPENEYE NAME: phosphoric acid; urea
CAS Name: phosphoric acid; urea
IUPAC NAME: phosphoric acid; urea
SYSTEMATIC NAME: phosphoric acid; urea
MOLECULAR FORMULA: CH7N2O5P
MOLECULAR WEIGHT: 158.050441
SMILES: C(=O)(N)N.OP(=O)(O)O
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Product OPENEYE NAME: 2-pentylthiophene
CAS Name: 2-pentylthiophene
IUPAC NAME: 2-pentylthiophene
SYSTEMATIC NAME: 2-pentylthiophene
MOLECULAR FORMULA: C9H14S
MOLECULAR WEIGHT: 154.27246
SMILES: CCCCCC1=CC=CS1
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