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

Systemtic Name: 5-chloranyl-2-methoxy-4-(2-methylpropanoylamino)benzoic acid Openeye Name: 5-chloro-2-methoxy-4-(2-methylpropanoylamino)benzoic acid CAS Name: 5-chloro-2-methoxy-4-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-(2-methylpropanoylamino)benzoic acid Traditional Name: 5-chloro-4-(isobutyrylamino)-2-methoxy-benzoic acid Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C(=C1)OC)C(=O)O)Cl

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C(=C1)OC)C(=O)O)Cl

InChI

InChI=1S/C12H14ClNO4/c1-6(2)11(15)14-9-5-10(18-3)7(12(16)17)4-8(9)13/h4-6H,1-3H3,(H,14,15)(H,16,17)