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

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [2-(4-benzyl-1-piperidyl)-2-oxo-ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [2-(4-benzylpiperidino)-2-keto-ethyl] ester Formula: C25H27N3O3 MolecularWeight: 417.50018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OCC(=O)N3CCC(CC3)CC4=CC=CC=C4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)OCC(=O)N3CCC(CC3)CC4=CC=CC=C4)N=C1C

InChI

InChI=1S/C25H27N3O3/c1-17-18(2)27-23-15-21(8-9-22(23)26-17)25(30)31-16-24(29)28-12-10-20(11-13-28)14-19-6-4-3-5-7-19/h3-9,15,20H,10-14,16H2,1-2H3