[3-[(4-methoxycarbonyl-3-oxidanyl-phenyl)amino]-3-oxidanylidene-propyl]-trimethyl-azanium iodide

Systemtic Name: [3-[(4-methoxycarbonyl-3-oxidanyl-phenyl)amino]-3-oxidanylidene-propyl]-trimethyl-azanium iodide Openeye Name: [3-(3-hydroxy-4-methoxycarbonyl-anilino)-3-oxo-propyl]-trimethyl-ammonium iodide CAS Name: [3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylammonium iodide IUPAC Name: [3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide Traditional Name: [3-(4-carbomethoxy-3-hydroxy-anilino)-3-keto-propyl]-trimethyl-ammonium iodide Formula: C14H21IN2O4 MolecularWeight: 408.23201

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)OC)O.[I-]

Isomeric SMILES

C[N+](C)(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)OC)O.[I-]

InChI

InChI=1S/C14H20N2O4.HI/c1-16(2,3)8-7-13(18)15-10-5-6-11(12(17)9-10)14(19)20-4;/h5-6,9H,7-8H2,1-4H3,(H-,15,17,18,19);1H