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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-(5-oxidanylpentyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-(5-hydroxypentyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-(5-hydroxypentyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-(5-hydroxypentyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-(5-hydroxypentyl)-9H-$b-carboline-3-carboxamide Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C4C(=CC(=N3)C(=O)NCCCCCO)C5=CC=CC=C5N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C4C(=CC(=N3)C(=O)NCCCCCO)C5=CC=CC=C5N4

InChI

InChI=1S/C24H23N3O4/c28-11-5-1-4-10-25-24(29)19-13-17-16-6-2-3-7-18(16)26-23(17)22(27-19)15-8-9-20-21(12-15)31-14-30-20/h2-3,6-9,12-13,26,28H,1,4-5,10-11,14H2,(H,25,29)