N-methyl-N-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-methyl-N-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-methyl-N-[2-[4-(m-tolylmethyl)piperazin-1-yl]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-methyl-N-[2-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-methyl-N-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[4-(3-methylbenzyl)piperazino]ethyl]-N-methyl-3-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CN(C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CN(C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-17-5-3-6-18(13-17)15-24-9-11-25(12-10-24)21(27)16-23(2)22(28)19-7-4-8-20(14-19)26(29)30/h3-8,13-14H,9-12,15-16H2,1-2H3