(phenylmethyl) 4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-oxidanylidene-pentanoate Openeye Name: benzyl 4-[bis(tert-butoxycarbonyl)amino]-3-oxo-pentanoate CAS Name: 4-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-oxopentanoate Traditional Name: 4-[bis(tert-butoxycarbonyl)amino]-3-keto-valeric acid benzyl ester Formula: C22H31NO7 MolecularWeight: 421.48404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31NO7/c1-15(17(24)13-18(25)28-14-16-11-9-8-10-12-16)23(19(26)29-21(2,3)4)20(27)30-22(5,6)7/h8-12,15H,13-14H2,1-7H3