benzoic acid; 2-[2-(methylamino)-1-oxidanyl-ethyl]phenol

Systemtic Name: benzoic acid; 2-[2-(methylamino)-1-oxidanyl-ethyl]phenol Openeye Name: benzoic acid; 2-[1-hydroxy-2-(methylamino)ethyl]phenol CAS Name: benzoic acid; 2-[1-hydroxy-2-(methylamino)ethyl]phenol IUPAC Name: benzoic acid; 2-[1-hydroxy-2-(methylamino)ethyl]phenol Traditional Name: benzoic acid; 2-[1-hydroxy-2-(methylamino)ethyl]phenol Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(C1=CC=CC=C1O)O.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CNCC(C1=CC=CC=C1O)O.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C9H13NO2.C7H6O2/c1-10-6-9(12)7-4-2-3-5-8(7)11;8-7(9)6-4-2-1-3-5-6/h2-5,9-12H,6H2,1H3;1-5H,(H,8,9)