methyl 3-[(3-bromophenyl)carbamoylamino]-6-cyano-2-oxidanyl-benzoate

Systemtic Name: methyl 3-[(3-bromophenyl)carbamoylamino]-6-cyano-2-oxidanyl-benzoate Openeye Name: methyl 3-[(3-bromophenyl)carbamoylamino]-6-cyano-2-hydroxy-benzoate CAS Name: 3-[[(3-bromoanilino)-oxomethyl]amino]-6-cyano-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 3-[(3-bromophenyl)carbamoylamino]-6-cyano-2-hydroxybenzoate Traditional Name: 3-[(3-bromophenyl)carbamoylamino]-6-cyano-2-hydroxy-benzoic acid methyl ester Formula: C16H12BrN3O4 MolecularWeight: 390.18818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1O)NC(=O)NC2=CC(=CC=C2)Br)C#N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1O)NC(=O)NC2=CC(=CC=C2)Br)C#N

InChI

InChI=1S/C16H12BrN3O4/c1-24-15(22)13-9(8-18)5-6-12(14(13)21)20-16(23)19-11-4-2-3-10(17)7-11/h2-7,21H,1H3,(H2,19,20,23)