oxolan-2-ylmethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: oxolan-2-ylmethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-7,7-dimethyl-2-methylidene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-5-keto-7,7-dimethyl-2-methylene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C25H28BrNO6 MolecularWeight: 518.39692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(C(=C)N2)C(=O)OCC3CCCO3)C4=CC5=C(C=C4Br)OCO5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(C(=C)N2)C(=O)OCC3CCCO3)C4=CC5=C(C=C4Br)OCO5)C(=O)C1)C

InChI

InChI=1S/C25H28BrNO6/c1-13-21(24(29)31-11-14-5-4-6-30-14)22(15-7-19-20(8-16(15)26)33-12-32-19)23-17(27-13)9-25(2,3)10-18(23)28/h7-8,14,21-22,27H,1,4-6,9-12H2,2-3H3