N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetamide Traditional Name: 2-(4-keto-5H-pyrimid[5,4-b]indol-3-yl)-N-veratryl-acetamide Formula: C21H20N4O4 MolecularWeight: 392.4079

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)NC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)NC4=CC=CC=C43)OC

InChI

InChI=1S/C21H20N4O4/c1-28-16-8-7-13(9-17(16)29-2)10-22-18(26)11-25-12-23-19-14-5-3-4-6-15(14)24-20(19)21(25)27/h3-9,12,24H,10-11H2,1-2H3,(H,22,26)