[3-(5-aminocarbonyl-2-oxidanyl-phenyl)-3-phenyl-propyl]-methyl-di(propan-2-yl)azanium iodide

Systemtic Name: [3-(5-aminocarbonyl-2-oxidanyl-phenyl)-3-phenyl-propyl]-methyl-di(propan-2-yl)azanium iodide Openeye Name: [3-(5-carbamoyl-2-hydroxy-phenyl)-3-phenyl-propyl]-diisopropyl-methyl-ammonium iodide CAS Name: [3-(5-carbamoyl-2-hydroxyphenyl)-3-phenylpropyl]-methyl-di(propan-2-yl)ammonium iodide IUPAC Name: [3-(5-carbamoyl-2-hydroxyphenyl)-3-phenylpropyl]-methyl-di(propan-2-yl)azanium iodide Traditional Name: [3-(5-carbamoyl-2-hydroxy-phenyl)-3-phenyl-propyl]-diisopropyl-methyl-ammonium iodide Formula: C23H33IN2O2 MolecularWeight: 496.42479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)N)O)C(C)C.[I-]

Isomeric SMILES

CC(C)[N+](C)(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)N)O)C(C)C.[I-]

InChI

InChI=1S/C23H32N2O2.HI/c1-16(2)25(5,17(3)4)14-13-20(18-9-7-6-8-10-18)21-15-19(23(24)27)11-12-22(21)26;/h6-12,15-17,20H,13-14H2,1-5H3,(H2-,24,26,27);1H