4-(4-ethylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-5H-pyrimido[5,4-b]indole IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5H-pyrimid[5,4-b]indole Formula: C16H20N5+ MolecularWeight: 282.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC=NC3=C2NC4=CC=CC=C43

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC=NC3=C2NC4=CC=CC=C43

InChI

InChI=1S/C16H19N5/c1-2-20-7-9-21(10-8-20)16-15-14(17-11-18-16)12-5-3-4-6-13(12)19-15/h3-6,11,19H,2,7-10H2,1H3/p+1