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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O2/c1-22-13-3-4-19(22)17-10-12-18(21-14-17)11-7-15-5-8-16(9-6-15)20(23)24-2/h5-6,8-10,12,14,19H,3-4,13H2,1-2H3