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

Systemtic Name: ethyl 2-methylidene-5-oxidanylidene-7-phenyl-4-(2-propan-2-yloxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC1=C)C4=CC=CC=C4OC(C)C

Isomeric SMILES

CCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC1=C)C4=CC=CC=C4OC(C)C

InChI

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