Product OPENEYE NAME: 3-(2-chlorophenothiazin-10-yl)propyl-trimethyl-ammonium iodide
CAS Name: 3-(2-chloro-10-phenothiazinyl)propyl-trimethylammonium iodide
IUPAC NAME: 3-(2-chlorophenothiazin-10-yl)propyl-trimethylazanium iodide
SYSTEMATIC NAME: 3-(2-chloranylphenothiazin-10-yl)propyl-trimethyl-azanium iodide
MOLECULAR FORMULA: C18H22ClIN2S
MOLECULAR WEIGHT: 460.80315
SMILES: C[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.[I-]
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Product OPENEYE NAME: 3-(2-chlorophenothiazin-10-yl)propyl-trimethyl-ammonium
CAS Name: 3-(2-chloro-10-phenothiazinyl)propyl-trimethylammonium
IUPAC NAME: 3-(2-chlorophenothiazin-10-yl)propyl-trimethylazanium
SYSTEMATIC NAME: 3-(2-chloranylphenothiazin-10-yl)propyl-trimethyl-azanium
MOLECULAR FORMULA: C18H22ClN2S+
MOLECULAR WEIGHT: 333.89868
SMILES: C[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl
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Product OPENEYE NAME: 13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,17-triol
CAS Name: 13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,17-triol
IUPAC NAME: 13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,17-triol
SYSTEMATIC NAME: 13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,17-triol
MOLECULAR FORMULA: C18H24O3
MOLECULAR WEIGHT: 288.38136
SMILES: CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)O)O
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Product OPENEYE NAME: 2,3-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
CAS Name: 2,3-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
IUPAC NAME: 2,3-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: 13-methyl-2,3-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C18H22O3
MOLECULAR WEIGHT: 286.36548
SMILES: CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)O)O
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Product OPENEYE NAME: 3-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
CAS Name: 3-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
IUPAC NAME: 3-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: 2-methoxy-13-methyl-3-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C19H24O3
MOLECULAR WEIGHT: 300.39206
SMILES: CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)OC)O
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Product OPENEYE NAME: [(4aR,6R,7R,7aR)-6-[6-(butanoylamino)purin-9-yl]-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl] butanoate
CAS Name: butanoic acid [(4aR,6R,7R,7aR)-2-hydroxy-2-oxo-6-[6-(1-oxobutylamino)-9-purinyl]-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-7-yl] ester
IUPAC NAME: [(4aR,6R,7R,7aR)-6-[6-(butanoylamino)purin-9-yl]-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl] butanoate
SYSTEMATIC NAME: [(4aR,6R,7R,7aR)-6-[6-(butanoylamino)purin-9-yl]-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl] butanoate
MOLECULAR FORMULA: C18H24N5O8P
MOLECULAR WEIGHT: 469.385621
SMILES: CCCC(=O)NC1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@H]4[C@H](O3)COP(=O)(O4)O)OC(=O)CCC
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Product OPENEYE NAME: 2-phenyl-1,4-benzoquinone
CAS Name: 2-phenylcyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2-phenylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2-phenylcyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C12H8O2
MOLECULAR WEIGHT: 184.19072
SMILES: C1=CC=C(C=C1)C2=CC(=O)C=CC2=O
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Product OPENEYE NAME: 1-benzylcyclohepta[d]imidazol-2-one
CAS Name: 1-(phenylmethyl)-2-cyclohepta[d]imidazolone
IUPAC NAME: 1-benzylcyclohepta[d]imidazol-2-one
SYSTEMATIC NAME: 1-(phenylmethyl)cyclohepta[d]imidazol-2-one
MOLECULAR FORMULA: C15H12N2O
MOLECULAR WEIGHT: 236.26858
SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=CC3=NC2=O
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Product OPENEYE NAME: N-(9H-fluoren-2-yl)-2,2,2-trifluoro-acetamide
CAS Name: N-(9H-fluoren-2-yl)-2,2,2-trifluoroacetamide
IUPAC NAME: N-(9H-fluoren-2-yl)-2,2,2-trifluoroacetamide
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)-N-(9H-fluoren-2-yl)ethanamide
MOLECULAR FORMULA: C15H10F3NO
MOLECULAR WEIGHT: 277.24121
SMILES: C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)C(F)(F)F
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Product OPENEYE NAME: 7-[(1R,2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
CAS Name: 7-[(1R,2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]-5-heptenoic acid
IUPAC NAME: 7-[(1R,2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
SYSTEMATIC NAME: 7-[(1R,2R,3R)-3-oxidanyl-5-oxidanylidene-2-[(3S)-3-oxidanyloct-1-enyl]cyclopentyl]hept-5-enoic acid
MOLECULAR FORMULA: C20H32O5
MOLECULAR WEIGHT: 352.46508
SMILES: CCCCC[C@@H](C=C[C@H]1[C@@H](CC(=O)[C@@H]1CC=CCCCC(=O)O)O)O
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Product OPENEYE NAME: 3-amino-1-(2-aminophenyl)propan-1-one
CAS Name: 3-amino-1-(2-aminophenyl)-1-propanone
IUPAC NAME: 3-amino-1-(2-aminophenyl)propan-1-one
SYSTEMATIC NAME: 1-(2-aminophenyl)-3-azanyl-propan-1-one
MOLECULAR FORMULA: C9H12N2O
MOLECULAR WEIGHT: 164.20438
SMILES: C1=CC=C(C(=C1)C(=O)CCN)N
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