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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-1-[(2-methylphenyl)methyl]-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-1-(o-tolylmethyl)-2-oxo-quinoline-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-1-[(2-methylphenyl)methyl]-2-oxo-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-1-[(2-methylphenyl)methyl]-2-oxoquinoline-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-keto-5,6-dimethoxy-1-(2-methylbenzyl)quinoline-3-carboxylic acid methyl ester Formula: C28H25NO7 MolecularWeight: 487.5006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C3=C(C(=C(C2=O)C(=O)OC)C4=CC5=C(C=C4)OCO5)C(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1CN2C3=C(C(=C(C2=O)C(=O)OC)C4=CC5=C(C=C4)OCO5)C(=C(C=C3)OC)OC

InChI

InChI=1S/C28H25NO7/c1-16-7-5-6-8-18(16)14-29-19-10-12-21(32-2)26(33-3)24(19)23(25(27(29)30)28(31)34-4)17-9-11-20-22(13-17)36-15-35-20/h5-13H,14-15H2,1-4H3