8-methyl-4-piperazin-4-ium-1-yl-5H-pyrimido[5,4-b]indole

Systemtic Name: 8-methyl-4-piperazin-4-ium-1-yl-5H-pyrimido[5,4-b]indole Openeye Name: 8-methyl-4-piperazin-4-ium-1-yl-5H-pyrimido[5,4-b]indole CAS Name: 8-methyl-4-(1-piperazin-4-iumyl)-5H-pyrimido[5,4-b]indole IUPAC Name: 8-methyl-4-piperazin-4-ium-1-yl-5H-pyrimido[5,4-b]indole Traditional Name: 8-methyl-4-piperazin-4-ium-1-yl-5H-pyrimid[5,4-b]indole Formula: C15H18N5+ MolecularWeight: 268.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CC[NH2+]CC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CC[NH2+]CC4

InChI

InChI=1S/C15H17N5/c1-10-2-3-12-11(8-10)13-14(19-12)15(18-9-17-13)20-6-4-16-5-7-20/h2-3,8-9,16,19H,4-7H2,1H3/p+1