3-(butan-2-ylcarbamoyl)benzoic acid

Systemtic Name: 3-(butan-2-ylcarbamoyl)benzoic acid Openeye Name: 3-(sec-butylcarbamoyl)benzoic acid CAS Name: 3-[(butan-2-ylamino)-oxomethyl]benzoic acid IUPAC Name: 3-(butan-2-ylcarbamoyl)benzoic acid Traditional Name: 3-(sec-butylcarbamoyl)benzoic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)C(=O)O

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=CC=C1)C(=O)O

InChI

InChI=1S/C12H15NO3/c1-3-8(2)13-11(14)9-5-4-6-10(7-9)12(15)16/h4-8H,3H2,1-2H3,(H,13,14)(H,15,16)