2-(4-azanyl-2,3,5-trimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-1-yl)ethyl-dimethyl-azanium

Systemtic Name: 2-(4-azanyl-2,3,5-trimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-1-yl)ethyl-dimethyl-azanium Openeye Name: 2-(4-amino-2,3,5-trimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-1-yl)ethyl-dimethyl-ammonium CAS Name: 2-(4-amino-2,3,5-trimethyl-6-phenyl-1-pyrrolo[2,3-b]pyridin-7-iumyl)ethyl-dimethylammonium IUPAC Name: 2-(4-amino-2,3,5-trimethyl-6-phenylpyrrolo[2,3-b]pyridin-7-ium-1-yl)ethyl-dimethylazanium Traditional Name: 2-(4-amino-2,3,5-trimethyl-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-1-yl)ethyl-dimethyl-ammonium Formula: C20H28N4+2 MolecularWeight: 324.46312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=[NH+]C(=C(C(=C12)N)C)C3=CC=CC=C3)CC[NH+](C)C)C

Isomeric SMILES

CC1=C(N(C2=[NH+]C(=C(C(=C12)N)C)C3=CC=CC=C3)CC[NH+](C)C)C

InChI

InChI=1S/C20H26N4/c1-13-15(3)24(12-11-23(4)5)20-17(13)18(21)14(2)19(22-20)16-9-7-6-8-10-16/h6-10H,11-12H2,1-5H3,(H2,21,22)/p+2