(phenylmethyl) (2S)-5-[(2-azanyl-2-oxidanylidene-ethyl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) (2S)-5-[(2-azanyl-2-oxidanylidene-ethyl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate Openeye Name: benzyl (2S)-5-[(2-amino-2-oxo-ethyl)amino]-2-(tert-butoxycarbonylamino)-5-oxo-pentanoate CAS Name: (2S)-5-[(2-amino-2-oxoethyl)amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-5-[(2-amino-2-oxoethyl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: (2S)-5-[(2-amino-2-keto-ethyl)amino]-2-(tert-butoxycarbonylamino)-5-keto-valeric acid benzyl ester Formula: C19H27N3O6 MolecularWeight: 393.43418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)NCC(=O)N)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)NCC(=O)N)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H27N3O6/c1-19(2,3)28-18(26)22-14(9-10-16(24)21-11-15(20)23)17(25)27-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H2,20,23)(H,21,24)(H,22,26)/t14-/m0/s1