3-[[1-(1,3-benzodioxol-5-yl)-9H-pyrido[3,4-b]indol-3-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[1-(1,3-benzodioxol-5-yl)-9H-pyrido[3,4-b]indol-3-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[1-(1,3-benzodioxol-5-yl)-9H-pyrido[3,4-b]indole-3-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[1-(1,3-benzodioxol-5-yl)-9H-pyrido[3,4-b]indol-3-yl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[1-(1,3-benzodioxol-5-yl)-9H-pyrido[3,4-b]indole-3-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[1-(1,3-benzodioxol-5-yl)-9H-$b-carboline-3-carbonyl]amino]propyl-dimethyl-ammonium Formula: C24H25N4O3+ MolecularWeight: 417.4803

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H24N4O3/c1-28(2)11-5-10-25-24(29)19-13-17-16-6-3-4-7-18(16)26-23(17)22(27-19)15-8-9-20-21(12-15)31-14-30-20/h3-4,6-9,12-13,26H,5,10-11,14H2,1-2H3,(H,25,29)/p+1