methyl 3-[[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]phenyl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]phenyl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]benzoyl]amino]propanoate CAS Name: 3-[[oxo-[2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]benzoyl]amino]propanoate Traditional Name: 3-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]benzoyl]amino]propionic acid methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=CC=CC=C1NC(=O)CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCNC(=O)C1=CC=CC=C1NC(=O)CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23N3O6/c1-29-19(26)11-12-22-20(27)16-9-5-6-10-17(16)24-18(25)13-23-21(28)30-14-15-7-3-2-4-8-15/h2-10H,11-14H2,1H3,(H,22,27)(H,23,28)(H,24,25)