N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-3-nitro-4-piperidino-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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