methyl 6,7-dimethoxy-1-oxidanylidene-2-(1-oxidanylidene-1,4-thiazinan-2-yl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 6,7-dimethoxy-1-oxidanylidene-2-(1-oxidanylidene-1,4-thiazinan-2-yl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 6,7-dimethoxy-1-oxo-2-(1-oxo-1,4-thiazinan-2-yl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 6,7-dimethoxy-1-oxo-2-(1-oxo-1,4-thiazinan-2-yl)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 6,7-dimethoxy-1-oxo-2-(1-oxo-1,4-thiazinan-2-yl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 1-keto-2-(1-keto-1,4-thiazinan-2-yl)-6,7-dimethoxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C26H30N2O9S MolecularWeight: 546.5894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC)C4CNCCS4=O)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC)C4CNCCS4=O)C(=O)OC

InChI

InChI=1S/C26H30N2O9S/c1-32-17-11-15-16(12-18(17)33-2)25(29)28(21-13-27-7-8-38(21)31)23(26(30)37-6)22(15)14-9-19(34-3)24(36-5)20(10-14)35-4/h9-12,21,27H,7-8,13H2,1-6H3