[5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]methanone CAS Name: [5-(3-methoxyphenyl)-2-(3-nitrophenyl)-3-pyrazolyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazol-3-yl]methanone Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H28N4O4/c1-37-26-12-5-9-23(18-26)27-20-28(32(30-27)24-10-6-11-25(19-24)33(35)36)29(34)31-15-13-22(14-16-31)17-21-7-3-2-4-8-21/h2-12,18-20,22H,13-17H2,1H3