tert-butyl 5-oxidanylidene-5-(3-oxidanylidenepropylamino)-4-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: tert-butyl 5-oxidanylidene-5-(3-oxidanylidenepropylamino)-4-(phenylmethoxycarbonylamino)pentanoate Openeye Name: tert-butyl 4-(benzyloxycarbonylamino)-5-oxo-5-(3-oxopropylamino)pentanoate CAS Name: 5-oxo-5-(3-oxopropylamino)-4-(phenylmethoxycarbonylamino)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-oxo-5-(3-oxopropylamino)-4-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 4-(benzyloxycarbonylamino)-5-keto-5-(3-ketopropylamino)valeric acid tert-butyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O6/c1-20(2,3)28-17(24)11-10-16(18(25)21-12-7-13-23)22-19(26)27-14-15-8-5-4-6-9-15/h4-6,8-9,13,16H,7,10-12,14H2,1-3H3,(H,21,25)(H,22,26)