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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-(phenylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-benzyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-(phenylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-benzyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-benzyl-9H-$b-carboline-3-carboxamide Formula: C26H19N3O3 MolecularWeight: 421.44736

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C4C(=CC(=N3)C(=O)NCC5=CC=CC=C5)C6=CC=CC=C6N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C4C(=CC(=N3)C(=O)NCC5=CC=CC=C5)C6=CC=CC=C6N4

InChI

InChI=1S/C26H19N3O3/c30-26(27-14-16-6-2-1-3-7-16)21-13-19-18-8-4-5-9-20(18)28-25(19)24(29-21)17-10-11-22-23(12-17)32-15-31-22/h1-13,28H,14-15H2,(H,27,30)