methane; 2-methoxynaphthalene; 2-[(1-methylpyridin-1-ium-3-yl)carbonylamino]ethyl ethanoate; iodide

Systemtic Name: methane; 2-methoxynaphthalene; 2-[(1-methylpyridin-1-ium-3-yl)carbonylamino]ethyl ethanoate; iodide Openeye Name: methane; 2-methoxynaphthalene; 2-[(1-methylpyridin-1-ium-3-carbonyl)amino]ethyl acetate; iodide CAS Name: acetic acid 2-[[(1-methyl-3-pyridin-1-iumyl)-oxomethyl]amino]ethyl ester; methane; 2-methoxynaphthalene; iodide IUPAC Name: methane; 2-methoxynaphthalene; 2-[(1-methylpyridin-1-ium-3-carbonyl)amino]ethyl acetate; iodide Traditional Name: acetic acid 2-[(1-methylpyridin-1-ium-3-carbonyl)amino]ethyl ester; methane; 2-methoxynaphthalene; iodide Formula: C23H29IN2O4 MolecularWeight: 524.39183

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Descriptors Computed from Structure

Canonical SMILES:

C.CC(=O)OCCNC(=O)C1=C[N+](=CC=C1)C.COC1=CC2=CC=CC=C2C=C1.[I-]

Isomeric SMILES

C.CC(=O)OCCNC(=O)C1=C[N+](=CC=C1)C.COC1=CC2=CC=CC=C2C=C1.[I-]

InChI

InChI=1S/C11H14N2O3.C11H10O.CH4.HI/c1-9(14)16-7-5-12-11(15)10-4-3-6-13(2)8-10;1-12-11-7-6-9-4-2-3-5-10(9)8-11;;/h3-4,6,8H,5,7H2,1-2H3;2-8H,1H3;1H4;1H