[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C16H10BrClN2O3 MolecularWeight: 393.6192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrClN2O3/c17-11-4-5-14(18)13(7-11)16(22)23-9-15(21)20-12-3-1-2-10(6-12)8-19/h1-7H,9H2,(H,20,21)