4-bromanyl-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-bromo-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-nitrobenzamide Traditional Name: 4-bromo-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-3-nitro-benzamide Formula: C17H16BrN3O4 MolecularWeight: 406.23064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O4/c1-11-3-6-13(7-4-11)19-16(22)10-20(2)17(23)12-5-8-14(18)15(9-12)21(24)25/h3-9H,10H2,1-2H3,(H,19,22)