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

Systemtic Name: (5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide Openeye Name: (5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide CAS Name: propanoic acid (5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl ester iodide IUPAC Name: (5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl propanoate iodide Traditional Name: propionic acid (5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl ester iodide Formula: C21H21IN2O2 MolecularWeight: 460.30811

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=CC=CC=C4N3)C.[I-]

Isomeric SMILES

CCC(=O)OC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=CC=CC=C4N3)C.[I-]

InChI

InChI=1S/C21H20N2O2.HI/c1-4-19(24)25-12-23-10-9-15-14(3)21-20(13(2)17(15)11-23)16-7-5-6-8-18(16)22-21;/h5-11H,4,12H2,1-3H3;1H