methyl 2-[[5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]ethanoate Openeye Name: methyl 2-[[5-amino-2-(benzyloxycarbonylamino)-5-oxo-pentanoyl]amino]acetate CAS Name: 2-[[5-amino-1,5-dioxo-2-(phenylmethoxycarbonylamino)pentyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoyl]amino]acetate Traditional Name: 2-[[5-amino-2-(benzyloxycarbonylamino)-5-keto-pentanoyl]amino]acetic acid methyl ester Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(CCC(=O)N)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CNC(=O)C(CCC(=O)N)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H21N3O6/c1-24-14(21)9-18-15(22)12(7-8-13(17)20)19-16(23)25-10-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H2,17,20)(H,18,22)(H,19,23)