(3,5-dimethylphenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3,5-dimethylphenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone Openeye Name: (3,5-dimethylphenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone CAS Name: (3,5-dimethylphenyl)-[4-[(4-nitrophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3,5-dimethylphenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3,5-dimethylphenyl)-[4-(4-nitrobenzyl)piperazino]methanone Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O3/c1-15-11-16(2)13-18(12-15)20(24)22-9-7-21(8-10-22)14-17-3-5-19(6-4-17)23(25)26/h3-6,11-13H,7-10,14H2,1-2H3