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

Systemtic Name: pentyl 4-(2,4-dimethoxyphenyl)-2,5,5-trimethyl-7-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: pentyl 4-(2,4-dimethoxyphenyl)-2,5,5-trimethyl-7-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 4-(2,4-dimethoxyphenyl)-2,5,5-trimethyl-7-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid pentyl ester IUPAC Name: pentyl 4-(2,4-dimethoxyphenyl)-2,5,5-trimethyl-7-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-(2,4-dimethoxyphenyl)-7-keto-2,5,5-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid amyl ester Formula: C26H35NO5 MolecularWeight: 441.5598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(NC2=C(C1C3=C(C=C(C=C3)OC)OC)C(CC(=O)C2)(C)C)C

Isomeric SMILES

CCCCCOC(=O)C1=C(NC2=C(C1C3=C(C=C(C=C3)OC)OC)C(CC(=O)C2)(C)C)C

InChI

InChI=1S/C26H35NO5/c1-7-8-9-12-32-25(29)22-16(2)27-20-13-17(28)15-26(3,4)24(20)23(22)19-11-10-18(30-5)14-21(19)31-6/h10-11,14,23,27H,7-9,12-13,15H2,1-6H3