ethyl 6-chloranyl-2-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-2-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-[[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]methyl]-4-phenyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-4-phenylquinoline-3-carboxylate Traditional Name: 6-chloro-2-[[(2S)-2-methylolpyrrolidino]methyl]-4-phenyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H25ClN2O3 MolecularWeight: 424.9199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Cl)CN4CCCC4CO

Isomeric SMILES

CCOC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Cl)CN4CCC[C@H]4CO

InChI

InChI=1S/C24H25ClN2O3/c1-2-30-24(29)23-21(14-27-12-6-9-18(27)15-28)26-20-11-10-17(25)13-19(20)22(23)16-7-4-3-5-8-16/h3-5,7-8,10-11,13,18,28H,2,6,9,12,14-15H2,1H3/t18-/m0/s1