4-azanyl-5-[2-(2-azanylethanoyl)-3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)phenyl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[2-(2-azanylethanoyl)-3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)phenyl]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[2-(2-aminoacetyl)-3-(2-amino-3-hydroxy-3-oxo-propyl)phenyl]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[3-(2-amino-3-hydroxy-3-oxopropyl)-2-(2-amino-1-oxoethyl)phenyl]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[2-(2-aminoacetyl)-3-(2-amino-3-hydroxy-3-oxopropyl)phenyl]-5-oxopentanoic acid Traditional Name: 4-amino-5-[3-(2-amino-3-hydroxy-3-keto-propyl)-2-glycyl-phenyl]-5-keto-valeric acid Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O6/c17-7-12(20)14-8(6-11(19)16(24)25)2-1-3-9(14)15(23)10(18)4-5-13(21)22/h1-3,10-11H,4-7,17-19H2,(H,21,22)(H,24,25)