4-(4-methoxycarbonylphenyl)butan-2-yl-[(1S)-1-phenylethyl]azanium chloride

Systemtic Name: 4-(4-methoxycarbonylphenyl)butan-2-yl-[(1S)-1-phenylethyl]azanium chloride Openeye Name: [3-(4-methoxycarbonylphenyl)-1-methyl-propyl]-[(1S)-1-phenylethyl]ammonium chloride CAS Name: 4-(4-methoxycarbonylphenyl)butan-2-yl-[(1S)-1-phenylethyl]ammonium chloride IUPAC Name: 4-(4-methoxycarbonylphenyl)butan-2-yl-[(1S)-1-phenylethyl]azanium chloride Traditional Name: [3-(4-carbomethoxyphenyl)-1-methyl-propyl]-[(1S)-1-phenylethyl]ammonium chloride Formula: C20H26ClNO2 MolecularWeight: 347.87894

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C(=O)OC)[NH2+]C(C)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH2+]C(C)CCC2=CC=C(C=C2)C(=O)OC.[Cl-]

InChI

InChI=1S/C20H25NO2.ClH/c1-15(21-16(2)18-7-5-4-6-8-18)9-10-17-11-13-19(14-12-17)20(22)23-3;/h4-8,11-16,21H,9-10H2,1-3H3;1H/t15?,16-;/m0./s1