methyl 4-(4-bromanyl-5-methyl-thiophen-2-yl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: methyl 4-(4-bromanyl-5-methyl-thiophen-2-yl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: methyl 4-(4-bromo-5-methyl-2-thienyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-bromo-5-methyl-2-thiophenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromo-5-methylthiophen-2-yl)-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(4-bromo-5-methyl-2-thienyl)-5-keto-2-methylene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester Formula: C17H18BrNO3S MolecularWeight: 396.29872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2C(C(=C)NC3=C2C(=O)CCC3)C(=O)OC)Br

Isomeric SMILES

CC1=C(C=C(S1)C2C(C(=C)NC3=C2C(=O)CCC3)C(=O)OC)Br

InChI

InChI=1S/C17H18BrNO3S/c1-8-14(17(21)22-3)16(13-7-10(18)9(2)23-13)15-11(19-8)5-4-6-12(15)20/h7,14,16,19H,1,4-6H2,2-3H3