[4-(diphenylmethyl)piperazin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-1-yl]-(3-nitro-1H-pyrazol-5-yl)methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(3-nitro-1H-pyrazol-5-yl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazinyl]-(3-nitro-1H-pyrazol-5-yl)methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(3-nitro-1H-pyrazol-5-yl)methanone Traditional Name: (4-benzhydrylpiperazino)-(3-nitro-1H-pyrazol-5-yl)methanone Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=NN4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=NN4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O3/c27-21(18-15-19(23-22-18)26(28)29)25-13-11-24(12-14-25)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,20H,11-14H2,(H,22,23)