(4,5-dimethoxy-2-nitro-phenyl)-(4-phenylmethoxypiperidin-1-yl)methanone

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-(4-phenylmethoxypiperidin-1-yl)methanone Openeye Name: (4-benzyloxy-1-piperidyl)-(4,5-dimethoxy-2-nitro-phenyl)methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-(4-phenylmethoxy-1-piperidinyl)methanone IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)-(4-phenylmethoxypiperidin-1-yl)methanone Traditional Name: (4-benzoxypiperidino)-(4,5-dimethoxy-2-nitro-phenyl)methanone Formula: C21H24N2O6 MolecularWeight: 400.42506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)OCC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)OCC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24N2O6/c1-27-19-12-17(18(23(25)26)13-20(19)28-2)21(24)22-10-8-16(9-11-22)29-14-15-6-4-3-5-7-15/h3-7,12-13,16H,8-11,14H2,1-2H3