[4-(dimethylamino)-3-nitro-phenyl]-(4-phenylmethoxypiperidin-1-yl)methanone

Systemtic Name: [4-(dimethylamino)-3-nitro-phenyl]-(4-phenylmethoxypiperidin-1-yl)methanone Openeye Name: (4-benzyloxy-1-piperidyl)-[4-(dimethylamino)-3-nitro-phenyl]methanone CAS Name: [4-(dimethylamino)-3-nitrophenyl]-(4-phenylmethoxy-1-piperidinyl)methanone IUPAC Name: [4-(dimethylamino)-3-nitrophenyl]-(4-phenylmethoxypiperidin-1-yl)methanone Traditional Name: (4-benzoxypiperidino)-[4-(dimethylamino)-3-nitro-phenyl]methanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-22(2)19-9-8-17(14-20(19)24(26)27)21(25)23-12-10-18(11-13-23)28-15-16-6-4-3-5-7-16/h3-9,14,18H,10-13,15H2,1-2H3