methyl 4-[2-[(2S)-2-(phenylcarbamoylamino)propanoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2S)-2-(phenylcarbamoylamino)propanoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(2S)-2-(phenylcarbamoylamino)propanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(2S)-2-[[anilino(oxo)methyl]amino]-1-oxopropoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2S)-2-(phenylcarbamoylamino)propanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(2S)-2-(phenylcarbamoylamino)propanoyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H21N3O6/c1-13(21-20(27)23-15-6-4-3-5-7-15)18(25)29-12-17(24)22-16-10-8-14(9-11-16)19(26)28-2/h3-11,13H,12H2,1-2H3,(H,22,24)(H2,21,23,27)/t13-/m0/s1