methyl 2-methylidene-5-oxidanylidene-7-phenyl-4-(2-propan-2-yloxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: methyl 2-methylidene-5-oxidanylidene-7-phenyl-4-(2-propan-2-yloxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: methyl 4-(2-isopropoxyphenyl)-2-methylene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 2-methylene-5-oxo-7-phenyl-4-(2-propan-2-yloxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methylidene-5-oxo-7-phenyl-4-(2-propan-2-yloxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(2-isopropoxyphenyl)-5-keto-2-methylene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CC=C4)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/h5-13,16,19,24-25,28H,3,14-15H2,1-2,4H3