2-[2-[(3-methylphenyl)carbonylamino]ethanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[2-[(3-methylphenyl)carbonylamino]ethanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[[2-[(3-methylbenzoyl)amino]acetyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[2-[(3-methylbenzoyl)amino]acetyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[2-(m-toluoylamino)acetyl]amino]butyric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)NC(C(C)O)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)NC(C(C)O)C(=O)O

InChI

InChI=1S/C14H18N2O5/c1-8-4-3-5-10(6-8)13(19)15-7-11(18)16-12(9(2)17)14(20)21/h3-6,9,12,17H,7H2,1-2H3,(H,15,19)(H,16,18)(H,20,21)