methyl (E)-3-[(2-bromophenyl)amino]-2-nitro-but-2-enoate

Systemtic Name: methyl (E)-3-[(2-bromophenyl)amino]-2-nitro-but-2-enoate Openeye Name: methyl (E)-3-(2-bromoanilino)-2-nitro-but-2-enoate CAS Name: (E)-3-(2-bromoanilino)-2-nitro-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-bromoanilino)-2-nitrobut-2-enoate Traditional Name: (E)-3-(2-bromoanilino)-2-nitro-but-2-enoic acid methyl ester Formula: C11H11BrN2O4 MolecularWeight: 315.12004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)[N+](=O)[O-])NC1=CC=CC=C1Br

Isomeric SMILES

C/C(=C(/C(=O)OC)\[N+](=O)[O-])/NC1=CC=CC=C1Br

InChI

InChI=1S/C11H11BrN2O4/c1-7(10(14(16)17)11(15)18-2)13-9-6-4-3-5-8(9)12/h3-6,13H,1-2H3/b10-7+