4-[methyl(2-methylpropyl)carbamoyl]benzoic acid

Systemtic Name: 4-[methyl(2-methylpropyl)carbamoyl]benzoic acid Openeye Name: 4-[isobutyl(methyl)carbamoyl]benzoic acid CAS Name: 4-[[methyl(2-methylpropyl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[methyl(2-methylpropyl)carbamoyl]benzoic acid Traditional Name: 4-[isobutyl(methyl)carbamoyl]benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C)C(=O)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C)CN(C)C(=O)C1=CC=C(C=C1)C(=O)O

InChI

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