2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 3-bromanyl-2-oxidanyl-benzaldehyde

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 3-bromanyl-2-oxidanyl-benzaldehyde Openeye Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 3-bromo-2-hydroxy-benzaldehyde CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 3-bromo-2-hydroxybenzaldehyde IUPAC Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 3-bromo-2-hydroxybenzaldehyde Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid; 3-bromo-2-hydroxy-benzaldehyde Formula: C16H16BrNO5 MolecularWeight: 382.20594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO3.C7H5BrO2/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;8-6-3-1-2-5(4-9)7(6)10/h1-4,8,11H,5,10H2,(H,12,13);1-4,10H