5-azanyl-2-[(4-methyl-3-oxidanyl-phenyl)carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(4-methyl-3-oxidanyl-phenyl)carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(3-hydroxy-4-methyl-benzoyl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[(3-hydroxy-4-methylphenyl)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(3-hydroxy-4-methylbenzoyl)amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(3-hydroxy-4-methyl-benzoyl)amino]-5-keto-valeric acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CCC(=O)N)C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(CCC(=O)N)C(=O)O)O

InChI

InChI=1S/C13H16N2O5/c1-7-2-3-8(6-10(7)16)12(18)15-9(13(19)20)4-5-11(14)17/h2-3,6,9,16H,4-5H2,1H3,(H2,14,17)(H,15,18)(H,19,20)