(phenylmethyl) 2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]piperazine-1-carboxylate Openeye Name: benzyl 2-[3-(tert-butoxycarbonylamino)-2,2-dimethyl-3-oxo-propyl]piperazine-1-carboxylate CAS Name: 2-[2,2-dimethyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]piperazine-1-carboxylate Traditional Name: 2-[3-(tert-butoxycarbonylamino)-3-keto-2,2-dimethyl-propyl]piperazine-1-carboxylic acid benzyl ester Formula: C22H33N3O5 MolecularWeight: 419.51452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=O)C(C)(C)CC1CNCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(=O)C(C)(C)CC1CNCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H33N3O5/c1-21(2,3)30-19(27)24-18(26)22(4,5)13-17-14-23-11-12-25(17)20(28)29-15-16-9-7-6-8-10-16/h6-10,17,23H,11-15H2,1-5H3,(H,24,26,27)