N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-1-(2-nitrophenyl)isonipecotamide 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)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

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