3-(4-aminocarbonylphenyl)propyl-(2-oxidanyl-2-phenyl-ethyl)azanium chloride

Systemtic Name: 3-(4-aminocarbonylphenyl)propyl-(2-oxidanyl-2-phenyl-ethyl)azanium chloride Openeye Name: 3-(4-carbamoylphenyl)propyl-(2-hydroxy-2-phenyl-ethyl)ammonium chloride CAS Name: 3-(4-carbamoylphenyl)propyl-(2-hydroxy-2-phenylethyl)ammonium chloride IUPAC Name: 3-(4-carbamoylphenyl)propyl-(2-hydroxy-2-phenylethyl)azanium chloride Traditional Name: 3-(4-carbamoylphenyl)propyl-(2-hydroxy-2-phenyl-ethyl)ammonium chloride Formula: C18H23ClN2O2 MolecularWeight: 334.84042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[NH2+]CCCC2=CC=C(C=C2)C(=O)N)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(C[NH2+]CCCC2=CC=C(C=C2)C(=O)N)O.[Cl-]

InChI

InChI=1S/C18H22N2O2.ClH/c19-18(22)16-10-8-14(9-11-16)5-4-12-20-13-17(21)15-6-2-1-3-7-15;/h1-3,6-11,17,20-21H,4-5,12-13H2,(H2,19,22);1H