5-chloranyl-4-(2-cyanoethanoylamino)-2-methoxy-benzoic acid

Systemtic Name: 5-chloranyl-4-(2-cyanoethanoylamino)-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-[(2-cyanoacetyl)amino]-2-methoxy-benzoic acid CAS Name: 5-chloro-4-[(2-cyano-1-oxoethyl)amino]-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-[(2-cyanoacetyl)amino]-2-methoxybenzoic acid Traditional Name: 5-chloro-4-[(2-cyanoacetyl)amino]-2-methoxy-benzoic acid Formula: C11H9ClN2O4 MolecularWeight: 268.65316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)CC#N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)CC#N

InChI

InChI=1S/C11H9ClN2O4/c1-18-9-5-8(14-10(15)2-3-13)7(12)4-6(9)11(16)17/h4-5H,2H2,1H3,(H,14,15)(H,16,17)