methyl 2-[(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonyloxymethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonyloxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[(2-acetamido-4,5-dimethyl-3-thiophenyl)-oxomethoxy]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-acetamido-4,5-dimethylthiophene-3-carbonyl)oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)oxymethyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=NC3=CC=CC=C3C(=C2C(=O)OC)C)NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=NC3=CC=CC=C3C(=C2C(=O)OC)C)NC(=O)C)C

InChI

InChI=1S/C22H22N2O5S/c1-11-13(3)30-20(23-14(4)25)19(11)22(27)29-10-17-18(21(26)28-5)12(2)15-8-6-7-9-16(15)24-17/h6-9H,10H2,1-5H3,(H,23,25)