[2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate Openeye Name: [2-(2-methyl-3-nitro-anilino)-2-oxo-ethyl] 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetic acid [2-(2-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-3-nitroanilino)-2-oxoethyl] 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetic acid [2-keto-2-(2-methyl-3-nitro-anilino)ethyl] ester Formula: C17H15BrClN3O7S MolecularWeight: 520.7389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrClN3O7S/c1-10-13(3-2-4-14(10)22(25)26)21-16(23)9-29-17(24)8-20-30(27,28)15-6-5-11(18)7-12(15)19/h2-7,20H,8-9H2,1H3,(H,21,23)