methyl 4-[2-[(3R)-3-acetamido-3-phenyl-propanoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(3R)-3-acetamido-3-phenyl-propanoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(3R)-3-acetamido-3-phenyl-propanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(3R)-3-acetamido-1-oxo-3-phenylpropoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(3R)-3-acetamido-3-phenylpropanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(3R)-3-acetamido-3-phenyl-propanoyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@H](CC(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C21H22N2O6/c1-14(24)22-18(15-6-4-3-5-7-15)12-20(26)29-13-19(25)23-17-10-8-16(9-11-17)21(27)28-2/h3-11,18H,12-13H2,1-2H3,(H,22,24)(H,23,25)/t18-/m1/s1