ethyl 9-methyl-2-(4-methylpiperidin-1-yl)pyrido[2,3-b]indol-1-ium-3-carboxylate

Systemtic Name: ethyl 9-methyl-2-(4-methylpiperidin-1-yl)pyrido[2,3-b]indol-1-ium-3-carboxylate Openeye Name: ethyl 9-methyl-2-(4-methyl-1-piperidyl)pyrido[2,3-b]indol-1-ium-3-carboxylate CAS Name: 9-methyl-2-(4-methyl-1-piperidinyl)-3-pyrido[2,3-b]indol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 9-methyl-2-(4-methylpiperidin-1-yl)pyrido[2,3-b]indol-1-ium-3-carboxylate Traditional Name: 9-methyl-2-(4-methylpiperidino)pyrid[2,3-b]indol-1-ium-3-carboxylic acid ethyl ester Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C([NH+]=C2C(=C1)C3=CC=CC=C3N2C)N4CCC(CC4)C

Isomeric SMILES

CCOC(=O)C1=C([NH+]=C2C(=C1)C3=CC=CC=C3N2C)N4CCC(CC4)C

InChI

InChI=1S/C21H25N3O2/c1-4-26-21(25)17-13-16-15-7-5-6-8-18(15)23(3)19(16)22-20(17)24-11-9-14(2)10-12-24/h5-8,13-14H,4,9-12H2,1-3H3/p+1