8-ethoxy-4-(4-methylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole

Systemtic Name: 8-ethoxy-4-(4-methylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole Openeye Name: 8-ethoxy-4-(4-methylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole CAS Name: 8-ethoxy-4-(4-methyl-1-piperazin-4-iumyl)-5H-pyrimido[5,4-b]indole IUPAC Name: 8-ethoxy-4-(4-methylpiperazin-4-ium-1-yl)-5H-pyrimido[5,4-b]indole Traditional Name: 8-ethoxy-4-(4-methylpiperazin-4-ium-1-yl)-5H-pyrimid[5,4-b]indole Formula: C17H22N5O+ MolecularWeight: 312.38948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O/c1-3-23-12-4-5-14-13(10-12)15-16(20-14)17(19-11-18-15)22-8-6-21(2)7-9-22/h4-5,10-11,20H,3,6-9H2,1-2H3/p+1