10-methoxy-7-methyl-2-(2-piperidin-1-ylethyl)pyrido[4,3-c]carbazol-2-ium ethanoate

Systemtic Name: 10-methoxy-7-methyl-2-(2-piperidin-1-ylethyl)pyrido[4,3-c]carbazol-2-ium ethanoate Openeye Name: 10-methoxy-7-methyl-2-[2-(1-piperidyl)ethyl]pyrido[4,3-c]carbazol-2-ium acetate CAS Name: 10-methoxy-7-methyl-2-[2-(1-piperidinyl)ethyl]pyrido[4,3-c]carbazol-2-ium acetate IUPAC Name: 10-methoxy-7-methyl-2-(2-piperidin-1-ylethyl)pyrido[4,3-c]carbazol-2-ium acetate Traditional Name: 10-methoxy-7-methyl-2-(2-piperidinoethyl)pyrido[4,3-c]carbazol-2-ium acetate Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CN1C2=C(C=C(C=C2)OC)C3=C1C=CC4=C3C=[N+](C=C4)CCN5CCCCC5

Isomeric SMILES

CC(=O)[O-].CN1C2=C(C=C(C=C2)OC)C3=C1C=CC4=C3C=[N+](C=C4)CCN5CCCCC5

InChI

InChI=1S/C24H28N3O.C2H4O2/c1-25-22-9-7-19(28-2)16-20(22)24-21-17-27(13-10-18(21)6-8-23(24)25)15-14-26-11-4-3-5-12-26;1-2(3)4/h6-10,13,16-17H,3-5,11-12,14-15H2,1-2H3;1H3,(H,3,4)/q+1;/p-1