methyl 4-methyl-2-[[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]methyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]methyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[(2R)-2-(2-thienyl)pyrrolidin-1-yl]methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]methyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[(2R)-2-(2-thienyl)pyrrolidino]methyl]quinoline-3-carboxylic acid methyl ester Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN3CCCC3C4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN3CCC[C@@H]3C4=CC=CS4)C(=O)OC

InChI

InChI=1S/C21H22N2O2S/c1-14-15-7-3-4-8-16(15)22-17(20(14)21(24)25-2)13-23-11-5-9-18(23)19-10-6-12-26-19/h3-4,6-8,10,12,18H,5,9,11,13H2,1-2H3/t18-/m1/s1