2-(4-azanyl-5-ethyl-2,3-dimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-1-yl)ethyl-dimethyl-azanium

Systemtic Name: 2-(4-azanyl-5-ethyl-2,3-dimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-1-yl)ethyl-dimethyl-azanium Openeye Name: 2-(4-amino-5-ethyl-2,3-dimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-1-yl)ethyl-dimethyl-ammonium CAS Name: 2-(4-amino-5-ethyl-2,3-dimethyl-6-phenyl-1-pyrrolo[2,3-b]pyridinyl)ethyl-dimethylammonium IUPAC Name: 2-(4-amino-5-ethyl-2,3-dimethyl-6-phenylpyrrolo[2,3-b]pyridin-1-yl)ethyl-dimethylazanium Traditional Name: 2-(4-amino-5-ethyl-2,3-dimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-1-yl)ethyl-dimethyl-ammonium Formula: C21H29N4+ MolecularWeight: 337.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C(=C1N)C(=C(N2CC[NH+](C)C)C)C)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(N=C2C(=C1N)C(=C(N2CC[NH+](C)C)C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4/c1-6-17-19(22)18-14(2)15(3)25(13-12-24(4)5)21(18)23-20(17)16-10-8-7-9-11-16/h7-11H,6,12-13H2,1-5H3,(H2,22,23)/p+1