2-acetyloxybenzoic acid; (1S,2S)-2-(methylamino)-1-phenyl-propan-1-ol

Systemtic Name: 2-acetyloxybenzoic acid; (1S,2S)-2-(methylamino)-1-phenyl-propan-1-ol Openeye Name: 2-acetoxybenzoic acid; (1S,2S)-2-(methylamino)-1-phenyl-propan-1-ol CAS Name: 2-acetyloxybenzoic acid; (1S,2S)-2-(methylamino)-1-phenyl-1-propanol IUPAC Name: 2-acetyloxybenzoic acid; (1S,2S)-2-(methylamino)-1-phenylpropan-1-ol Traditional Name: 2-acetoxybenzoic acid; (1S,2S)-2-(methylamino)-1-phenyl-propan-1-ol Formula: C19H23NO5 MolecularWeight: 345.38962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)NC.CC(=O)OC1=CC=CC=C1C(=O)O

Isomeric SMILES

C[C@@H]([C@H](C1=CC=CC=C1)O)NC.CC(=O)OC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C10H15NO.C9H8O4/c1-8(11-2)10(12)9-6-4-3-5-7-9;1-6(10)13-8-5-3-2-4-7(8)9(11)12/h3-8,10-12H,1-2H3;2-5H,1H3,(H,11,12)/t8-,10+;/m0./s1