5-azanyl-2-[2-[3,4-bis(oxidanyl)phenyl]ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-[3,4-bis(oxidanyl)phenyl]ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[2-(3,4-dihydroxyphenyl)ethylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[2-(3,4-dihydroxyphenyl)ethylamino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[2-(3,4-dihydroxyphenyl)ethylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[2-(3,4-dihydroxyphenyl)ethylamino]-5-keto-valeric acid Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCNC(CCC(=O)N)C(=O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1CCNC(CCC(=O)N)C(=O)O)O)O

InChI

InChI=1S/C13H18N2O5/c14-12(18)4-2-9(13(19)20)15-6-5-8-1-3-10(16)11(17)7-8/h1,3,7,9,15-17H,2,4-6H2,(H2,14,18)(H,19,20)