methyl 2,6,6-trimethyl-4-(3-methylphenyl)-5-oxidanylidene-1,4,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl 2,6,6-trimethyl-4-(3-methylphenyl)-5-oxidanylidene-1,4,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 2,6,6-trimethyl-4-(m-tolyl)-5-oxo-1,4,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,6,6-trimethyl-4-(3-methylphenyl)-5-oxo-1,4,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2,6,6-trimethyl-4-(3-methylphenyl)-5-oxo-1,4,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,6,6-trimethyl-4-(m-tolyl)-1,4,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=C(CCC(C3=O)(C)C)NC(=C2C(=O)OC)C

Isomeric SMILES

CC1=CC=CC(=C1)C2C3=C(CCC(C3=O)(C)C)NC(=C2C(=O)OC)C

InChI

InChI=1S/C21H25NO3/c1-12-7-6-8-14(11-12)17-16(20(24)25-5)13(2)22-15-9-10-21(3,4)19(23)18(15)17/h6-8,11,17,22H,9-10H2,1-5H3