(2S)-2-oxidanyl-2-phenyl-ethanoic acid; (2R)-2-phenylpropan-1-amine

Systemtic Name: (2S)-2-oxidanyl-2-phenyl-ethanoic acid; (2R)-2-phenylpropan-1-amine Openeye Name: (2S)-2-hydroxy-2-phenyl-acetic acid; (2R)-2-phenylpropan-1-amine CAS Name: (2S)-2-hydroxy-2-phenylacetic acid; (2R)-2-phenyl-1-propanamine IUPAC Name: (2S)-2-hydroxy-2-phenylacetic acid; (2R)-2-phenylpropan-1-amine Traditional Name: (2S)-2-hydroxy-2-phenyl-acetic acid; [(2R)-2-phenylpropyl]amine Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)C1=CC=CC=C1.C1=CC=C(C=C1)C(C(=O)O)O

Isomeric SMILES

C[C@@H](CN)C1=CC=CC=C1.C1=CC=C(C=C1)[C@@H](C(=O)O)O

InChI

InChI=1S/C9H13N.C8H8O3/c1-8(7-10)9-5-3-2-4-6-9;9-7(8(10)11)6-4-2-1-3-5-6/h2-6,8H,7,10H2,1H3;1-5,7,9H,(H,10,11)/t8-;7-/m00/s1