3-phenyl-2-(phenylmethyl)propanoic acid; pyridin-2-ylmethanol; hydrochloride

Systemtic Name: 3-phenyl-2-(phenylmethyl)propanoic acid; pyridin-2-ylmethanol; hydrochloride Openeye Name: 2-benzyl-3-phenyl-propanoic acid; 2-pyridylmethanol; hydrochloride CAS Name: 3-phenyl-2-(phenylmethyl)propanoic acid; 2-pyridinylmethanol; hydrochloride IUPAC Name: 2-benzyl-3-phenylpropanoic acid; pyridin-2-ylmethanol; hydrochloride Traditional Name: 2-benzyl-3-phenyl-propionic acid; 2-pyridylmethanol; hydrochloride Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)C(=O)O.C1=CC=NC(=C1)CO.Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)C(=O)O.C1=CC=NC(=C1)CO.Cl

InChI

InChI=1S/C16H16O2.C6H7NO.ClH/c17-16(18)15(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14;8-5-6-3-1-2-4-7-6;/h1-10,15H,11-12H2,(H,17,18);1-4,8H,5H2;1H