(phenylmethyl) 2-[2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino]ethanoate Openeye Name: benzyl 2-[[2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]acetyl]amino]acetate CAS Name: 2-[[2-[[3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-1-oxoethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]amino]acetate Traditional Name: 2-[[2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]acetyl]amino]acetic acid benzyl ester Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)CNC(=O)C(CO)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)CNC(=O)C(CO)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25N3O7/c26-13-18(25-22(30)32-15-17-9-5-2-6-10-17)21(29)24-11-19(27)23-12-20(28)31-14-16-7-3-1-4-8-16/h1-10,18,26H,11-15H2,(H,23,27)(H,24,29)(H,25,30)