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

Systemtic Name: dibutyl-[3-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]azanium Openeye Name: dibutyl-[3-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]ammonium CAS Name: dibutyl-[3-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]ammonium IUPAC Name: dibutyl-[3-[(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]azanium Traditional Name: dibutyl-[3-[(8-methoxy-5H-pyrimid[5,4-b]indol-4-yl)amino]propyl]ammonium Formula: C22H34N5O+ MolecularWeight: 384.53826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N5O/c1-4-6-12-27(13-7-5-2)14-8-11-23-22-21-20(24-16-25-22)18-15-17(28-3)9-10-19(18)26-21/h9-10,15-16,26H,4-8,11-14H2,1-3H3,(H,23,24,25)/p+1