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

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C17H13BrClN3O5S MolecularWeight: 486.72422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)COC(=O)CNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)COC(=O)CNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl)C#N

InChI

InChI=1S/C17H13BrClN3O5S/c18-12-4-5-15(14(19)7-12)28(25,26)21-9-17(24)27-10-16(23)22-13-3-1-2-11(6-13)8-20/h1-7,21H,9-10H2,(H,22,23)