(2S)-2-[3-(3-methylphenoxy)propanoylamino]propanoate

Systemtic Name: (2S)-2-[3-(3-methylphenoxy)propanoylamino]propanoate Openeye Name: (2S)-2-[3-(3-methylphenoxy)propanoylamino]propanoate CAS Name: (2S)-2-[[3-(3-methylphenoxy)-1-oxopropyl]amino]propanoate IUPAC Name: (2S)-2-[3-(3-methylphenoxy)propanoylamino]propanoate Traditional Name: (2S)-2-[3-(3-methylphenoxy)propanoylamino]propionate Formula: C13H16NO4- MolecularWeight: 250.27044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)NC(C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)N[C@@H](C)C(=O)[O-]

InChI

InChI=1S/C13H17NO4/c1-9-4-3-5-11(8-9)18-7-6-12(15)14-10(2)13(16)17/h3-5,8,10H,6-7H2,1-2H3,(H,14,15)(H,16,17)/p-1/t10-/m0/s1