(4-imidazol-1-yl-3-nitro-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-(4-imidazol-1-yl-3-nitro-phenyl)methanone CAS Name: [4-(1-imidazolyl)-3-nitrophenyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(4-imidazol-1-yl-3-nitrophenyl)methanone Traditional Name: (4-benzylpiperidino)-(4-imidazol-1-yl-3-nitro-phenyl)methanone Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O3/c27-22(24-11-8-18(9-12-24)14-17-4-2-1-3-5-17)19-6-7-20(21(15-19)26(28)29)25-13-10-23-16-25/h1-7,10,13,15-16,18H,8-9,11-12,14H2