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

Systemtic Name: N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(2,3-dimethylanilino)-2-keto-ethyl]-N-methyl-3-nitro-4-pyrrolidino-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C

InChI

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