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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-cyclooctyl-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-cyclooctyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-cyclooctyl-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-cyclooctyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-cyclooctyl-9H-$b-carboline-3-carboxamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H27N3O3/c31-27(28-18-8-4-2-1-3-5-9-18)22-15-20-19-10-6-7-11-21(19)29-26(20)25(30-22)17-12-13-23-24(14-17)33-16-32-23/h6-7,10-15,18,29H,1-5,8-9,16H2,(H,28,31)