2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 2-azanyl-3-(4-methoxy-3-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 2-azanyl-3-(4-methoxy-3-oxidanyl-phenyl)propanoic acid Openeye Name: 2-amino-3-(3-hydroxy-4-methoxy-phenyl)propanoic acid; 2-amino-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-amino-3-(3-hydroxy-4-methoxyphenyl)propanoic acid; 2-amino-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-amino-3-(3-hydroxy-4-methoxyphenyl)propanoic acid; 2-amino-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-amino-3-(3-hydroxy-4-methoxy-phenyl)propionic acid; 2-amino-3-(4-hydroxyphenyl)propionic acid Formula: C19H24N2O7 MolecularWeight: 392.40306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(C(=O)O)N)O.C1=CC(=CC=C1CC(C(=O)O)N)O

Isomeric SMILES

COC1=C(C=C(C=C1)CC(C(=O)O)N)O.C1=CC(=CC=C1CC(C(=O)O)N)O

InChI

InChI=1S/C10H13NO4.C9H11NO3/c1-15-9-3-2-6(5-8(9)12)4-7(11)10(13)14;10-8(9(12)13)5-6-1-3-7(11)4-2-6/h2-3,5,7,12H,4,11H2,1H3,(H,13,14);1-4,8,11H,5,10H2,(H,12,13)