[3-[(4-ethoxycarbonyl-3-oxidanyl-phenyl)amino]-3-oxidanylidene-propyl]-diethyl-methyl-azanium iodide

Systemtic Name: [3-[(4-ethoxycarbonyl-3-oxidanyl-phenyl)amino]-3-oxidanylidene-propyl]-diethyl-methyl-azanium iodide Openeye Name: [3-(4-ethoxycarbonyl-3-hydroxy-anilino)-3-oxo-propyl]-diethyl-methyl-ammonium iodide CAS Name: [3-(4-ethoxycarbonyl-3-hydroxyanilino)-3-oxopropyl]-diethyl-methylammonium iodide IUPAC Name: [3-(4-ethoxycarbonyl-3-hydroxyanilino)-3-oxopropyl]-diethyl-methylazanium iodide Traditional Name: [3-(4-carbethoxy-3-hydroxy-anilino)-3-keto-propyl]-diethyl-methyl-ammonium iodide Formula: C17H27IN2O4 MolecularWeight: 450.31175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O4.HI/c1-5-19(4,6-2)11-10-16(21)18-13-8-9-14(15(20)12-13)17(22)23-7-3;/h8-9,12H,5-7,10-11H2,1-4H3,(H-,18,20,21,22);1H