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

Systemtic Name: oxolan-2-ylmethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-7-(furan-2-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-7-(2-furyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-7-(2-furanyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-7-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-7-(2-furyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C27H26BrNO7 MolecularWeight: 556.40184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CO3)C4=CC5=C(C=C4Br)OCO5)C(=O)OCC6CCCO6

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CO3)C4=CC5=C(C=C4Br)OCO5)C(=O)OCC6CCCO6

InChI

InChI=1S/C27H26BrNO7/c1-14-24(27(31)34-12-16-4-2-6-32-16)25(17-10-22-23(11-18(17)28)36-13-35-22)26-19(29-14)8-15(9-20(26)30)21-5-3-7-33-21/h3,5,7,10-11,15-16,25,29H,2,4,6,8-9,12-13H2,1H3