2-(5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-N,N-diethyl-ethanamine; ethanoic acid

Systemtic Name: 2-(5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-N,N-diethyl-ethanamine; ethanoic acid Openeye Name: acetic acid; 2-(5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-N,N-diethyl-ethanamine CAS Name: acetic acid; 2-(5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-N,N-diethylethanamine IUPAC Name: acetic acid; 2-(5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-N,N-diethylethanamine Traditional Name: acetic acid; 2-(5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)ethyl-diethyl-amine Formula: C25H32N3O2+ MolecularWeight: 406.54048

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=CC=CC=C4N3)C.CC(=O)O

Isomeric SMILES

CCN(CC)CC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=CC=CC=C4N3)C.CC(=O)O

InChI

InChI=1S/C23H27N3.C2H4O2/c1-5-25(6-2)13-14-26-12-11-18-17(4)23-22(16(3)20(18)15-26)19-9-7-8-10-21(19)24-23;1-2(3)4/h7-12,15H,5-6,13-14H2,1-4H3;1H3,(H,3,4)/p+1