4-azanyl-3-[3,4-bis(oxidanyl)phenyl]butanoic acid

Systemtic Name: 4-azanyl-3-[3,4-bis(oxidanyl)phenyl]butanoic acid Openeye Name: 4-amino-3-(3,4-dihydroxyphenyl)butanoic acid CAS Name: 4-amino-3-(3,4-dihydroxyphenyl)butanoic acid IUPAC Name: 4-amino-3-(3,4-dihydroxyphenyl)butanoic acid Traditional Name: 4-amino-3-(3,4-dihydroxyphenyl)butyric acid Formula: C10H13NO4 MolecularWeight: 211.21452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(CC(=O)O)CN)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(CC(=O)O)CN)O)O

InChI

InChI=1S/C10H13NO4/c11-5-7(4-10(14)15)6-1-2-8(12)9(13)3-6/h1-3,7,12-13H,4-5,11H2,(H,14,15)