1-(2,5-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(2,5-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(2,5-dimethoxyphenyl)-N-(4-pyridylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(2,5-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(2,5-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(2,5-dimethoxyphenyl)-N-(4-pyridylmethyl)-9H-$b-carboline-3-carboxamide Formula: C26H22N4O3 MolecularWeight: 438.47788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=C3C(=CC(=N2)C(=O)NCC4=CC=NC=C4)C5=CC=CC=C5N3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=C3C(=CC(=N2)C(=O)NCC4=CC=NC=C4)C5=CC=CC=C5N3

InChI

InChI=1S/C26H22N4O3/c1-32-17-7-8-23(33-2)20(13-17)25-24-19(18-5-3-4-6-21(18)29-24)14-22(30-25)26(31)28-15-16-9-11-27-12-10-16/h3-14,29H,15H2,1-2H3,(H,28,31)