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

Systemtic Name: dibutyl-[3-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)propyl]azanium Openeye Name: dibutyl-[3-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propyl]ammonium CAS Name: dibutyl-[3-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propyl]ammonium IUPAC Name: dibutyl-[3-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)propyl]azanium Traditional Name: dibutyl-[3-(4-keto-5H-pyrimid[5,4-b]indol-3-yl)propyl]ammonium Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCCN1C=NC2=C(C1=O)NC3=CC=CC=C32

Isomeric SMILES

CCCC[NH+](CCCC)CCCN1C=NC2=C(C1=O)NC3=CC=CC=C32

InChI

InChI=1S/C21H30N4O/c1-3-5-12-24(13-6-4-2)14-9-15-25-16-22-19-17-10-7-8-11-18(17)23-20(19)21(25)26/h7-8,10-11,16,23H,3-6,9,12-15H2,1-2H3/p+1