phenethyl 4-(4-acetyloxyphenyl)-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: phenethyl 4-(4-acetyloxyphenyl)-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: phenethyl 4-(4-acetoxyphenyl)-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(4-acetyloxyphenyl)-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester IUPAC Name: phenethyl 4-(4-acetyloxyphenyl)-7,7-dimethyl-2-methylidene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(4-acetoxyphenyl)-5-keto-7,7-dimethyl-2-methylene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)(C)C)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)(C)C)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C29H31NO5/c1-18-25(28(33)34-15-14-20-8-6-5-7-9-20)26(21-10-12-22(13-11-21)35-19(2)31)27-23(30-18)16-29(3,4)17-24(27)32/h5-13,25-26,30H,1,14-17H2,2-4H3