(2S)-2-[[2,4-bis(oxidanyl)phenyl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[[2,4-bis(oxidanyl)phenyl]carbonylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(2,4-dihydroxybenzoyl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2,4-dihydroxyphenyl)-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(2,4-dihydroxybenzoyl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(2,4-dihydroxybenzoyl)amino]-4-methyl-valerate Formula: C13H16NO5- MolecularWeight: 266.26984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C1=C(C=C(C=C1)O)O

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)C1=C(C=C(C=C1)O)O

InChI

InChI=1S/C13H17NO5/c1-7(2)5-10(13(18)19)14-12(17)9-4-3-8(15)6-11(9)16/h3-4,6-7,10,15-16H,5H2,1-2H3,(H,14,17)(H,18,19)/p-1/t10-/m0/s1