3-methyl-4-pyrrolidin-1-ylcarbonyl-benzoic acid

Systemtic Name: 3-methyl-4-pyrrolidin-1-ylcarbonyl-benzoic acid Openeye Name: 3-methyl-4-(pyrrolidine-1-carbonyl)benzoic acid CAS Name: 3-methyl-4-[oxo(1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 3-methyl-4-(pyrrolidine-1-carbonyl)benzoic acid Traditional Name: 3-methyl-4-(pyrrolidine-1-carbonyl)benzoic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)C(=O)N2CCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)C(=O)N2CCCC2

InChI

InChI=1S/C13H15NO3/c1-9-8-10(13(16)17)4-5-11(9)12(15)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3,(H,16,17)