3-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-4-(carboxymethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-4-(carboxymethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 3-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-(carboxymethylamino)-4-oxo-butanoic acid CAS Name: 3-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-4-(carboxymethylamino)-4-oxobutanoic acid IUPAC Name: 3-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-(carboxymethylamino)-4-oxobutanoic acid Traditional Name: 4-(carboxymethylamino)-4-keto-3-(tyrosylamino)butyric acid Formula: C15H19N3O7 MolecularWeight: 353.32726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)NC(CC(=O)O)C(=O)NCC(=O)O)N)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)NC(CC(=O)O)C(=O)NCC(=O)O)N)O

InChI

InChI=1S/C15H19N3O7/c16-10(5-8-1-3-9(19)4-2-8)14(24)18-11(6-12(20)21)15(25)17-7-13(22)23/h1-4,10-11,19H,5-7,16H2,(H,17,25)(H,18,24)(H,20,21)(H,22,23)