[4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-[(5-methyl-3-nitropyrazol-1-yl)methyl]phenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(4-phenylpiperazino)methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O3/c1-17-15-21(27(29)30)23-26(17)16-18-7-9-19(10-8-18)22(28)25-13-11-24(12-14-25)20-5-3-2-4-6-20/h2-10,15H,11-14,16H2,1H3