oxolan-2-ylmethyl 4-(3-bromophenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: oxolan-2-ylmethyl 4-(3-bromophenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 4-(3-bromophenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(3-bromophenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 4-(3-bromophenyl)-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(3-bromophenyl)-5-keto-2-methylene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C22H24BrNO4 MolecularWeight: 446.33426

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)Br)C(=O)OCC4CCCO4

Isomeric SMILES

C=C1C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)Br)C(=O)OCC4CCCO4

InChI

InChI=1S/C22H24BrNO4/c1-13-19(22(26)28-12-16-7-4-10-27-16)20(14-5-2-6-15(23)11-14)21-17(24-13)8-3-9-18(21)25/h2,5-6,11,16,19-20,24H,1,3-4,7-10,12H2