N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-N-propyl-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2-methylanilino)-2-oxo-ethyl]-3-nitro-N-propyl-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2-methylanilino)-2-oxoethyl]-3-nitro-N-propyl-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2-methylanilino)-2-oxoethyl]-3-nitro-N-propyl-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-keto-2-(o-toluidino)ethyl]-3-nitro-N-propyl-4-pyrrolidino-benzamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O4/c1-3-12-26(16-22(28)24-19-9-5-4-8-17(19)2)23(29)18-10-11-20(21(15-18)27(30)31)25-13-6-7-14-25/h4-5,8-11,15H,3,6-7,12-14,16H2,1-2H3,(H,24,28)