dibutyl-[3-[(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]azanium

Systemtic Name: dibutyl-[3-[(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]azanium Openeye Name: dibutyl-[3-[(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]ammonium CAS Name: dibutyl-[3-[(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]ammonium IUPAC Name: dibutyl-[3-[(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]azanium Traditional Name: dibutyl-[3-[(8-ethoxy-5H-pyrimid[5,4-b]indol-4-yl)amino]propyl]ammonium Formula: C23H36N5O+ MolecularWeight: 398.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCCNC1=NC=NC2=C1NC3=C2C=C(C=C3)OCC

Isomeric SMILES

CCCC[NH+](CCCC)CCCNC1=NC=NC2=C1NC3=C2C=C(C=C3)OCC

InChI

InChI=1S/C23H35N5O/c1-4-7-13-28(14-8-5-2)15-9-12-24-23-22-21(25-17-26-23)19-16-18(29-6-3)10-11-20(19)27-22/h10-11,16-17,27H,4-9,12-15H2,1-3H3,(H,24,25,26)/p+1