[4-[(4-nitropyrazol-1-yl)methyl]phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-[(4-nitropyrazol-1-yl)methyl]phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[4-[(4-nitropyrazol-1-yl)methyl]phenyl]methanone CAS Name: [4-[(4-nitro-1-pyrazolyl)methyl]phenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[4-[(4-nitropyrazol-1-yl)methyl]phenyl]methanone Traditional Name: (4-benzylpiperazino)-[4-[(4-nitropyrazol-1-yl)methyl]phenyl]methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CN4C=C(C=N4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CN4C=C(C=N4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O3/c28-22(25-12-10-24(11-13-25)15-18-4-2-1-3-5-18)20-8-6-19(7-9-20)16-26-17-21(14-23-26)27(29)30/h1-9,14,17H,10-13,15-16H2