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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

InChI

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