3-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[2-(1-piperidin-1-iumyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C17H21N4O+ MolecularWeight: 297.37484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C=NC3=C(C2=O)NC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](CC1)CCN2C=NC3=C(C2=O)NC4=CC=CC=C43

InChI

InChI=1S/C17H20N4O/c22-17-16-15(13-6-2-3-7-14(13)19-16)18-12-21(17)11-10-20-8-4-1-5-9-20/h2-3,6-7,12,19H,1,4-5,8-11H2/p+1