methyl 2-[[(5-chloranylthiophen-2-yl)methyl-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[(5-chloranylthiophen-2-yl)methyl-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[(5-chloro-2-thienyl)methyl-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[(5-chloro-2-thiophenyl)methyl-methylamino]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(5-chlorothiophen-2-yl)methyl-methylamino]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[(5-chloro-2-thienyl)methyl-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C19H19ClN2O2S MolecularWeight: 374.88436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN(C)CC3=CC=C(S3)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN(C)CC3=CC=C(S3)Cl)C(=O)OC

InChI

InChI=1S/C19H19ClN2O2S/c1-12-14-6-4-5-7-15(14)21-16(18(12)19(23)24-3)11-22(2)10-13-8-9-17(20)25-13/h4-9H,10-11H2,1-3H3