(4-methoxyphenyl)methyl 7,7-dimethyl-2-methylidene-4-(3-methylphenyl)-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 7,7-dimethyl-2-methylidene-4-(3-methylphenyl)-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: (4-methoxyphenyl)methyl 7,7-dimethyl-2-methylene-4-(m-tolyl)-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 7,7-dimethyl-2-methylene-4-(3-methylphenyl)-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 7,7-dimethyl-2-methylidene-4-(3-methylphenyl)-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 5-keto-7,7-dimethyl-2-methylene-4-(m-tolyl)-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid p-anisyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)(C)C)C(=O)OCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)(C)C)C(=O)OCC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H31NO4/c1-17-7-6-8-20(13-17)25-24(27(31)33-16-19-9-11-21(32-5)12-10-19)18(2)29-22-14-28(3,4)15-23(30)26(22)25/h6-13,24-25,29H,2,14-16H2,1,3-5H3