2-(pentan-2-ylcarbamoyl)benzoic acid

Systemtic Name: 2-(pentan-2-ylcarbamoyl)benzoic acid Openeye Name: 2-(1-methylbutylcarbamoyl)benzoic acid CAS Name: 2-[oxo-(pentan-2-ylamino)methyl]benzoic acid IUPAC Name: 2-(pentan-2-ylcarbamoyl)benzoic acid Traditional Name: 2-(1-methylbutylcarbamoyl)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCC(C)NC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H17NO3/c1-3-6-9(2)14-12(15)10-7-4-5-8-11(10)13(16)17/h4-5,7-9H,3,6H2,1-2H3,(H,14,15)(H,16,17)