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

Systemtic Name: 4-[2-[5-(1-methylpyrrolidin-2-yl)pyridin-3-yl]ethynyl]benzoic acid Openeye Name: 4-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridyl]ethynyl]benzoic acid CAS Name: 4-[2-[5-(1-methyl-2-pyrrolidinyl)-3-pyridinyl]ethynyl]benzoic acid IUPAC Name: 4-[2-[5-(1-methylpyrrolidin-2-yl)pyridin-3-yl]ethynyl]benzoic acid Traditional Name: 4-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridyl]ethynyl]benzoic acid Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C2=CN=CC(=C2)C#CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1CCCC1C2=CN=CC(=C2)C#CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H18N2O2/c1-21-10-2-3-18(21)17-11-15(12-20-13-17)5-4-14-6-8-16(9-7-14)19(22)23/h6-9,11-13,18H,2-3,10H2,1H3,(H,22,23)