4-azanyl-2-[3-(3-methylphenoxy)propanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[3-(3-methylphenoxy)propanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[3-(3-methylphenoxy)propanoylamino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[3-(3-methylphenoxy)-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[3-(3-methylphenoxy)propanoylamino]-4-oxobutanoic acid Traditional Name: 4-amino-4-keto-2-[3-(3-methylphenoxy)propanoylamino]butyric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C14H18N2O5/c1-9-3-2-4-10(7-9)21-6-5-13(18)16-11(14(19)20)8-12(15)17/h2-4,7,11H,5-6,8H2,1H3,(H2,15,17)(H,16,18)(H,19,20)