(4-methylphenyl)-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (4-methylphenyl)-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]methanone Openeye Name: [4-[(3-nitrophenyl)methyl]piperazin-1-yl]-(p-tolyl)methanone CAS Name: (4-methylphenyl)-[4-[(3-nitrophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-methylphenyl)-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]methanone Traditional Name: [4-(3-nitrobenzyl)piperazino]-(p-tolyl)methanone Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3/c1-15-5-7-17(8-6-15)19(23)21-11-9-20(10-12-21)14-16-3-2-4-18(13-16)22(24)25/h2-8,13H,9-12,14H2,1H3