(4-nitrophenyl)methyl 4-[1-(4-dimethylaminophenyl)carbonylpiperidin-4-yl]piperidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-[1-(4-dimethylaminophenyl)carbonylpiperidin-4-yl]piperidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-[1-[4-(dimethylamino)benzoyl]-4-piperidyl]piperidine-1-carboxylate CAS Name: 4-[1-[(4-dimethylaminophenyl)-oxomethyl]-4-piperidinyl]-1-piperidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]piperidine-1-carboxylate Traditional Name: 4-[1-[4-(dimethylamino)benzoyl]-4-piperidyl]piperidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C27H34N4O5 MolecularWeight: 494.58266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C3CCN(CC3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C3CCN(CC3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H34N4O5/c1-28(2)24-9-5-23(6-10-24)26(32)29-15-11-21(12-16-29)22-13-17-30(18-14-22)27(33)36-19-20-3-7-25(8-4-20)31(34)35/h3-10,21-22H,11-19H2,1-2H3