2-azanyl-2-(3-methoxy-4-oxidanyl-phenyl)ethanoic acid hydrate

Systemtic Name: 2-azanyl-2-(3-methoxy-4-oxidanyl-phenyl)ethanoic acid hydrate Openeye Name: 2-amino-2-(4-hydroxy-3-methoxy-phenyl)acetic acid hydrate CAS Name: 2-amino-2-(4-hydroxy-3-methoxyphenyl)acetic acid hydrate IUPAC Name: 2-amino-2-(4-hydroxy-3-methoxyphenyl)acetic acid hydrate Traditional Name: 2-amino-2-(4-hydroxy-3-methoxy-phenyl)acetic acid hydrate Formula: C9H13NO5 MolecularWeight: 215.20322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)O)N)O.O

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)O)N)O.O

InChI

InChI=1S/C9H11NO4.H2O/c1-14-7-4-5(2-3-6(7)11)8(10)9(12)13;/h2-4,8,11H,10H2,1H3,(H,12,13);1H2