[4,4-diphenyl-5-(phenylcarbamoyloxy)heptan-2-yl]-dimethyl-azanium chloride

Systemtic Name: [4,4-diphenyl-5-(phenylcarbamoyloxy)heptan-2-yl]-dimethyl-azanium chloride Openeye Name: dimethyl-[1-methyl-3,3-diphenyl-4-(phenylcarbamoyloxy)hexyl]ammonium chloride CAS Name: [5-[anilino(oxo)methoxy]-4,4-diphenylheptan-2-yl]-dimethylammonium chloride IUPAC Name: [4,4-diphenyl-5-(phenylcarbamoyloxy)heptan-2-yl]-dimethylazanium chloride Traditional Name: dimethyl-[1-methyl-3,3-diphenyl-4-(phenylcarbamoyloxy)hexyl]ammonium chloride Formula: C28H35ClN2O2 MolecularWeight: 467.0427

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC(C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)NC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCC(C(CC(C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)NC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C28H34N2O2.ClH/c1-5-26(32-27(31)29-25-19-13-8-14-20-25)28(21-22(2)30(3)4,23-15-9-6-10-16-23)24-17-11-7-12-18-24;/h6-20,22,26H,5,21H2,1-4H3,(H,29,31);1H