(4,5-dimethoxy-2-nitro-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-(4,5-dimethoxy-2-nitro-phenyl)methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(4,5-dimethoxy-2-nitrophenyl)methanone Traditional Name: (4-benzylpiperidino)-(4,5-dimethoxy-2-nitro-phenyl)methanone Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24N2O5/c1-27-19-13-17(18(23(25)26)14-20(19)28-2)21(24)22-10-8-16(9-11-22)12-15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3