(phenylmethyl) 4-(4-ethoxyphenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-ethoxyphenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: benzyl 4-(4-ethoxyphenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-ethoxyphenyl)-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 5-keto-2-methylene-4-p-phenetyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid benzyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)CCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)CCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27NO4/c1-3-30-20-14-12-19(13-15-20)24-23(26(29)31-16-18-8-5-4-6-9-18)17(2)27-21-10-7-11-22(28)25(21)24/h4-6,8-9,12-15,23-24,27H,2-3,7,10-11,16H2,1H3