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

Systemtic Name: 1-(2,4-dimethoxyphenyl)-N-(5-oxidanylpentyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(2,4-dimethoxyphenyl)-N-(5-hydroxypentyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(2,4-dimethoxyphenyl)-N-(5-hydroxypentyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(2,4-dimethoxyphenyl)-N-(5-hydroxypentyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(2,4-dimethoxyphenyl)-N-(5-hydroxypentyl)-9H-$b-carboline-3-carboxamide Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCCCCCO)C4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCCCCCO)C4=CC=CC=C4N3)OC

InChI

InChI=1S/C25H27N3O4/c1-31-16-10-11-18(22(14-16)32-2)23-24-19(17-8-4-5-9-20(17)27-24)15-21(28-23)25(30)26-12-6-3-7-13-29/h4-5,8-11,14-15,27,29H,3,6-7,12-13H2,1-2H3,(H,26,30)