(9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide

Systemtic Name: (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide Openeye Name: (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide CAS Name: propanoic acid (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl ester iodide IUPAC Name: (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide Traditional Name: propionic acid (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl ester iodide Formula: C22H23IN2O3 MolecularWeight: 490.33409

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=C(N3)C=CC(=C4)OC)C.[I-]

Isomeric SMILES

CCC(=O)OC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=C(N3)C=CC(=C4)OC)C.[I-]

InChI

InChI=1S/C22H22N2O3.HI/c1-5-20(25)27-12-24-9-8-16-14(3)22-21(13(2)18(16)11-24)17-10-15(26-4)6-7-19(17)23-22;/h6-11H,5,12H2,1-4H3;1H