6-ethyl-2,3,5-trimethyl-1-(pyridin-4-ylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-amine

Systemtic Name: 6-ethyl-2,3,5-trimethyl-1-(pyridin-4-ylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-amine Openeye Name: 6-ethyl-2,3,5-trimethyl-1-(4-pyridylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-amine CAS Name: 6-ethyl-2,3,5-trimethyl-1-(pyridin-4-ylmethyl)-4-pyrrolo[2,3-b]pyridin-7-iumamine IUPAC Name: 6-ethyl-2,3,5-trimethyl-1-(pyridin-4-ylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-amine Traditional Name: [6-ethyl-2,3,5-trimethyl-1-(4-pyridylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-yl]amine Formula: C18H23N4+ MolecularWeight: 295.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C(N(C2=[NH+]1)CC3=CC=NC=C3)C)C)N)C

Isomeric SMILES

CCC1=C(C(=C2C(=C(N(C2=[NH+]1)CC3=CC=NC=C3)C)C)N)C

InChI

InChI=1S/C18H22N4/c1-5-15-12(3)17(19)16-11(2)13(4)22(18(16)21-15)10-14-6-8-20-9-7-14/h6-9H,5,10H2,1-4H3,(H2,19,21)/p+1