methyl 8,8-dimethyl-4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)-3,4,4a,8a-tetrahydro-2H-quinoline-3-carboxylate

Systemtic Name: methyl 8,8-dimethyl-4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)-3,4,4a,8a-tetrahydro-2H-quinoline-3-carboxylate Openeye Name: methyl 1-benzyl-4-hydroxy-8,8-dimethyl-5-oxo-3,4,4a,8a-tetrahydro-2H-quinoline-3-carboxylate CAS Name: 4-hydroxy-8,8-dimethyl-5-oxo-1-(phenylmethyl)-3,4,4a,8a-tetrahydro-2H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4-hydroxy-8,8-dimethyl-5-oxo-3,4,4a,8a-tetrahydro-2H-quinoline-3-carboxylate Traditional Name: 1-benzyl-4-hydroxy-5-keto-8,8-dimethyl-3,4,4a,8a-tetrahydro-2H-quinoline-3-carboxylic acid methyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C2C1N(CC(C2O)C(=O)OC)CC3=CC=CC=C3)C

Isomeric SMILES

CC1(C=CC(=O)C2C1N(CC(C2O)C(=O)OC)CC3=CC=CC=C3)C

InChI

InChI=1S/C20H25NO4/c1-20(2)10-9-15(22)16-17(23)14(19(24)25-3)12-21(18(16)20)11-13-7-5-4-6-8-13/h4-10,14,16-18,23H,11-12H2,1-3H3