N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: [(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl-(5H-pyrimid[5,4-b]indol-4-yl)amine Formula: C17H22N5+ MolecularWeight: 296.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC2=NC=NC3=C2NC4=CC=CC=C43

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC2=NC=NC3=C2NC4=CC=CC=C43

InChI

InChI=1S/C17H21N5/c1-2-22-9-5-6-12(22)10-18-17-16-15(19-11-20-17)13-7-3-4-8-14(13)21-16/h3-4,7-8,11-12,21H,2,5-6,9-10H2,1H3,(H,18,19,20)/p+1/t12-/m1/s1