2-(3-azanyl-4-cyano-pyrido[4,3-b]indol-2-ium-5-yl)ethyl-diethyl-azanium

Systemtic Name: 2-(3-azanyl-4-cyano-pyrido[4,3-b]indol-2-ium-5-yl)ethyl-diethyl-azanium Openeye Name: 2-(3-amino-4-cyano-pyrido[4,3-b]indol-2-ium-5-yl)ethyl-diethyl-ammonium CAS Name: 2-(3-amino-4-cyano-5-pyrido[4,3-b]indol-2-iumyl)ethyl-diethylammonium IUPAC Name: 2-(3-amino-4-cyanopyrido[4,3-b]indol-2-ium-5-yl)ethyl-diethylazanium Traditional Name: 2-(3-amino-4-cyano-pyrid[4,3-b]indol-2-ium-5-yl)ethyl-diethyl-ammonium Formula: C18H23N5+2 MolecularWeight: 309.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2C3=C[NH+]=C(C(=C31)C#N)N

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2C3=C[NH+]=C(C(=C31)C#N)N

InChI

InChI=1S/C18H21N5/c1-3-22(4-2)9-10-23-16-8-6-5-7-13(16)15-12-21-18(20)14(11-19)17(15)23/h5-8,12H,3-4,9-10H2,1-2H3,(H2,20,21)/p+2