[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] 2,3-diphenylquinoxaline-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] 2,3-diphenylquinoxaline-6-carboxylate Openeye Name: [2-(4-benzyl-1-piperidyl)-2-oxo-ethyl] 2,3-diphenylquinoxaline-6-carboxylate CAS Name: 2,3-diphenyl-6-quinoxalinecarboxylic acid [2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2,3-diphenylquinoxaline-6-carboxylate Traditional Name: 2,3-diphenylquinoxaline-6-carboxylic acid [2-(4-benzylpiperidino)-2-keto-ethyl] ester Formula: C35H31N3O3 MolecularWeight: 541.63894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=CC4=C(C=C3)N=C(C(=N4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=CC4=C(C=C3)N=C(C(=N4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H31N3O3/c39-32(38-20-18-26(19-21-38)22-25-10-4-1-5-11-25)24-41-35(40)29-16-17-30-31(23-29)37-34(28-14-8-3-9-15-28)33(36-30)27-12-6-2-7-13-27/h1-17,23,26H,18-22,24H2