methyl (4S)-4-(4-bromanylthiophen-2-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: methyl (4S)-4-(4-bromanylthiophen-2-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: methyl (4S)-4-(4-bromo-2-thienyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-4-(4-bromo-2-thiophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(4-bromothiophen-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-4-(4-bromo-2-thienyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid methyl ester Formula: C16H16BrNO3S MolecularWeight: 382.27214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC)C3=CC(=CS3)Br)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@H](C1C(=O)OC)C3=CC(=CS3)Br)C(=O)CCC2

InChI

InChI=1S/C16H16BrNO3S/c1-8-13(16(20)21-2)15(12-6-9(17)7-22-12)14-10(18-8)4-3-5-11(14)19/h6-7,13,15H,3-5H2,1-2H3/t13?,15-/m0/s1