(2R)-4-azanyl-2-[2-(2,3-dimethylphenoxy)ethanoylamino]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-azanyl-2-[2-(2,3-dimethylphenoxy)ethanoylamino]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-amino-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-4-oxo-butanoate CAS Name: (2R)-4-amino-2-[[2-(2,3-dimethylphenoxy)-1-oxoethyl]amino]-4-oxobutanoate IUPAC Name: (2R)-4-amino-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-4-oxobutanoate Traditional Name: (2R)-4-amino-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-4-keto-butyrate Formula: C14H17N2O5- MolecularWeight: 293.29518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c1-8-4-3-5-11(9(8)2)21-7-13(18)16-10(14(19)20)6-12(15)17/h3-5,10H,6-7H2,1-2H3,(H2,15,17)(H,16,18)(H,19,20)/p-1/t10-/m1/s1