methyl 4-[2-[5-(1-methylpyrrolidin-2-yl)pyridin-3-yl]ethynyl]benzoate

Systemtic Name: methyl 4-[2-[5-(1-methylpyrrolidin-2-yl)pyridin-3-yl]ethynyl]benzoate Openeye Name: methyl 4-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridyl]ethynyl]benzoate CAS Name: 4-[2-[5-(1-methyl-2-pyrrolidinyl)-3-pyridinyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[5-(1-methylpyrrolidin-2-yl)pyridin-3-yl]ethynyl]benzoate Traditional Name: 4-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridyl]ethynyl]benzoic acid methyl ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O2/c1-22-11-3-4-19(22)18-12-16(13-21-14-18)6-5-15-7-9-17(10-8-15)20(23)24-2/h7-10,12-14,19H,3-4,11H2,1-2H3