methyl 2-methyl-5-oxidanylidene-7-phenyl-4-(2-propan-2-yloxyphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: methyl 2-methyl-5-oxidanylidene-7-phenyl-4-(2-propan-2-yloxyphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: methyl 4-(2-isopropoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 2-methyl-5-oxo-7-phenyl-4-(2-propan-2-yloxyphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-oxo-7-phenyl-4-(2-propan-2-yloxyphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(2-isopropoxyphenyl)-5-keto-2-methyl-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CC(C=C2N1)C3=CC=CC=C3)C4=CC=CC=C4OC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(C2C(=O)CC(C=C2N1)C3=CC=CC=C3)C4=CC=CC=C4OC(C)C)C(=O)OC

InChI

InChI=1S/C27H29NO4/c1-16(2)32-23-13-9-8-12-20(23)25-24(27(30)31-4)17(3)28-21-14-19(15-22(29)26(21)25)18-10-6-5-7-11-18/h5-14,16,19,25-26,28H,15H2,1-4H3