ethyl 4-(3-bromanylthiophen-2-yl)-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 4-(3-bromanylthiophen-2-yl)-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 4-(3-bromo-2-thienyl)-2-oxo-6-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: 4-(3-bromo-2-thiophenyl)-2-oxo-6-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromothiophen-2-yl)-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate Traditional Name: 4-(3-bromo-2-thienyl)-2-keto-6-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C19H17BrO3S MolecularWeight: 405.30548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=C(C=CS2)Br)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1C(CC(=CC1=O)C2=C(C=CS2)Br)C3=CC=CC=C3

InChI

InChI=1S/C19H17BrO3S/c1-2-23-19(22)17-14(12-6-4-3-5-7-12)10-13(11-16(17)21)18-15(20)8-9-24-18/h3-9,11,14,17H,2,10H2,1H3