4-[[[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-(5-chloro-2-nitro-anilino)-2-oxo-ethyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-(5-chloro-2-nitroanilino)-2-oxoethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-(5-chloro-2-nitroanilino)-2-oxoethyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-(5-chloro-2-nitro-anilino)-2-keto-ethyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C18H19ClN4O4 MolecularWeight: 390.82086

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)CC(=O)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)CC(=O)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN4O4/c1-20-18(25)13-5-3-12(4-6-13)10-22(2)11-17(24)21-15-9-14(19)7-8-16(15)23(26)27/h3-9H,10-11H2,1-2H3,(H,20,25)(H,21,24)