(phenylmethyl) 5-azanyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 5-azanyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-5-oxidanylidene-pentanoate Openeye Name: benzyl 5-amino-2-[2-(tert-butoxycarbonylamino)propanoylamino]-5-oxo-pentanoate CAS Name: 5-amino-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-amino-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-5-oxopentanoate Traditional Name: 5-amino-2-[2-(tert-butoxycarbonylamino)propanoylamino]-5-keto-valeric acid benzyl ester Formula: C20H29N3O6 MolecularWeight: 407.46076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O6/c1-13(22-19(27)29-20(2,3)4)17(25)23-15(10-11-16(21)24)18(26)28-12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H2,21,24)(H,22,27)(H,23,25)