ethyl 4-(4-bromanyl-5-methyl-thiophen-2-yl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 4-(4-bromanyl-5-methyl-thiophen-2-yl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-(4-bromo-5-methyl-2-thienyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(4-bromo-5-methyl-2-thiophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-5-methylthiophen-2-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(4-bromo-5-methyl-2-thienyl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H20BrNO3S MolecularWeight: 410.3253

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CCCC(=O)C2C1C3=CC(=C(S3)C)Br)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=CCCC(=O)C2C1C3=CC(=C(S3)C)Br)C

InChI

InChI=1S/C18H20BrNO3S/c1-4-23-18(22)15-9(2)20-12-6-5-7-13(21)16(12)17(15)14-8-11(19)10(3)24-14/h6,8,16-17,20H,4-5,7H2,1-3H3