N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-5-nitro-2-piperidino-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C22H26N4O4/c1-16-6-8-17(9-7-16)23-21(27)15-24(2)22(28)19-14-18(26(29)30)10-11-20(19)25-12-4-3-5-13-25/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,23,27)