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

Systemtic Name: 2-[4-cyano-3-(dimethylaminomethylideneamino)pyrido[4,3-b]indol-5-yl]ethyl-diethyl-azanium Openeye Name: 2-[4-cyano-3-(dimethylaminomethyleneamino)pyrido[4,3-b]indol-5-yl]ethyl-diethyl-ammonium CAS Name: 2-[4-cyano-3-(dimethylaminomethylideneamino)-5-pyrido[4,3-b]indolyl]ethyl-diethylammonium IUPAC Name: 2-[4-cyano-3-(dimethylaminomethylideneamino)pyrido[4,3-b]indol-5-yl]ethyl-diethylazanium Traditional Name: 2-[4-cyano-3-(dimethylaminomethyleneamino)pyrid[4,3-b]indol-5-yl]ethyl-diethyl-ammonium Formula: C21H27N6+ MolecularWeight: 363.47928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N6/c1-5-26(6-2)11-12-27-19-10-8-7-9-16(19)18-14-23-21(24-15-25(3)4)17(13-22)20(18)27/h7-10,14-15H,5-6,11-12H2,1-4H3/p+1