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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=C3C(=CC(=N2)C(=O)NCC4=CN=CC=C4)C5=CC=CC=C5N3

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=C3C(=CC(=N2)C(=O)NCC4=CN=CC=C4)C5=CC=CC=C5N3

InChI

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