2-[4-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(8-ethoxy-5H-pyrimid[5,4-b]indol-4-yl)piperazin-1-ium-1-yl]ethanol Formula: C18H24N5O2+ MolecularWeight: 342.41546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CC[NH+](CC4)CCO

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CC[NH+](CC4)CCO

InChI

InChI=1S/C18H23N5O2/c1-2-25-13-3-4-15-14(11-13)16-17(21-15)18(20-12-19-16)23-7-5-22(6-8-23)9-10-24/h3-4,11-12,21,24H,2,5-10H2,1H3/p+1