(phenylmethyl) 4-azanyl-3-[[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 4-azanyl-3-[[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-4-oxidanylidene-butanoate Openeye Name: benzyl 4-amino-3-[[2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]-4-oxo-butanoate CAS Name: 4-amino-3-[[4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-amino-3-[[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-4-oxobutanoate Traditional Name: 4-amino-3-[[2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]-4-keto-butyric acid benzyl ester Formula: C22H33N3O6 MolecularWeight: 435.51392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3O6/c1-14(2)11-17(25-21(29)31-22(3,4)5)20(28)24-16(19(23)27)12-18(26)30-13-15-9-7-6-8-10-15/h6-10,14,16-17H,11-13H2,1-5H3,(H2,23,27)(H,24,28)(H,25,29)