4-cyano-3-[4-(2-methylpropanoylamino)phenyl]carbonyloxy-benzoic acid

Systemtic Name: 4-cyano-3-[4-(2-methylpropanoylamino)phenyl]carbonyloxy-benzoic acid Openeye Name: 4-cyano-3-[4-(2-methylpropanoylamino)benzoyl]oxy-benzoic acid CAS Name: 4-cyano-3-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethoxy]benzoic acid IUPAC Name: 4-cyano-3-[4-(2-methylpropanoylamino)benzoyl]oxybenzoic acid Traditional Name: 4-cyano-3-[4-(isobutyrylamino)benzoyl]oxy-benzoic acid Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)O)C#N

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)O)C#N

InChI

InChI=1S/C19H16N2O5/c1-11(2)17(22)21-15-7-5-12(6-8-15)19(25)26-16-9-13(18(23)24)3-4-14(16)10-20/h3-9,11H,1-2H3,(H,21,22)(H,23,24)