methyl 4-(1,3-benzodioxol-5-yl)-1-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-1-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-1-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-oxo-quinoline-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-1-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-oxo-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-1-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-oxoquinoline-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-1-(2,5-dimethoxybenzyl)-2-keto-5,6-dimethoxy-quinoline-3-carboxylic acid methyl ester Formula: C29H27NO9 MolecularWeight: 533.52598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2C3=C(C(=C(C2=O)C(=O)OC)C4=CC5=C(C=C4)OCO5)C(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2C3=C(C(=C(C2=O)C(=O)OC)C4=CC5=C(C=C4)OCO5)C(=C(C=C3)OC)OC

InChI

InChI=1S/C29H27NO9/c1-33-18-7-10-20(34-2)17(12-18)14-30-19-8-11-22(35-3)27(36-4)25(19)24(26(28(30)31)29(32)37-5)16-6-9-21-23(13-16)39-15-38-21/h6-13H,14-15H2,1-5H3