5-oxidanylidene-5-(1-oxidanylidenepropan-2-ylamino)-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-oxidanylidene-5-(1-oxidanylidenepropan-2-ylamino)-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-5-[(1-methyl-2-oxo-ethyl)amino]-5-oxo-pentanoic acid CAS Name: 5-oxo-5-(1-oxopropan-2-ylamino)-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-oxo-5-(1-oxopropan-2-ylamino)-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-5-keto-5-[(2-keto-1-methyl-ethyl)amino]valeric acid Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)NC(=O)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C=O)NC(=O)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H20N2O6/c1-11(9-19)17-14(20)8-7-13(15(21)22)18-16(23)24-10-12-5-3-2-4-6-12/h2-6,9,11,13H,7-8,10H2,1H3,(H,17,20)(H,18,23)(H,21,22)