4-[5-(2-methylpyrrolidin-1-yl)carbonylpyridin-3-yl]benzoic acid

Systemtic Name: 4-[5-(2-methylpyrrolidin-1-yl)carbonylpyridin-3-yl]benzoic acid Openeye Name: 4-[5-(2-methylpyrrolidine-1-carbonyl)-3-pyridyl]benzoic acid CAS Name: 4-[5-[(2-methyl-1-pyrrolidinyl)-oxomethyl]-3-pyridinyl]benzoic acid IUPAC Name: 4-[5-(2-methylpyrrolidine-1-carbonyl)pyridin-3-yl]benzoic acid Traditional Name: 4-[5-(2-methylpyrrolidine-1-carbonyl)-3-pyridyl]benzoic acid Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1C(=O)C2=CN=CC(=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1CCCN1C(=O)C2=CN=CC(=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H18N2O3/c1-12-3-2-8-20(12)17(21)16-9-15(10-19-11-16)13-4-6-14(7-5-13)18(22)23/h4-7,9-12H,2-3,8H2,1H3,(H,22,23)