(4-aminocarbonylphenyl)methyl 1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: (4-aminocarbonylphenyl)methyl 1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 1-butyl-2-(4-methoxyphenyl)-6-oxo-piperidine-3-carboxylate CAS Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 1-butyl-2-(4-methoxyphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: 1-butyl-6-keto-2-(4-methoxyphenyl)nipecotic acid (4-carbamoylbenzyl) ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)OCC2=CC=C(C=C2)C(=O)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)OCC2=CC=C(C=C2)C(=O)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H30N2O5/c1-3-4-15-27-22(28)14-13-21(23(27)18-9-11-20(31-2)12-10-18)25(30)32-16-17-5-7-19(8-6-17)24(26)29/h5-12,21,23H,3-4,13-16H2,1-2H3,(H2,26,29)