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

Systemtic Name: 3-[(8-chloranyl-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(8-chloro-5H-pyrimid[5,4-b]indol-4-yl)amino]propyl-dimethyl-ammonium Formula: C15H19ClN5+ MolecularWeight: 304.79786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN5/c1-21(2)7-3-6-17-15-14-13(18-9-19-15)11-8-10(16)4-5-12(11)20-14/h4-5,8-9,20H,3,6-7H2,1-2H3,(H,17,18,19)/p+1