tert-butyl (NZ)-N-[[(2-methylpropan-2-yl)oxycarbonylamino]-(4-phenylpiperazin-1-yl)methylidene]carbamate

Systemtic Name: tert-butyl (NZ)-N-[[(2-methylpropan-2-yl)oxycarbonylamino]-(4-phenylpiperazin-1-yl)methylidene]carbamate Openeye Name: tert-butyl (NZ)-N-[(tert-butoxycarbonylamino)-(4-phenylpiperazin-1-yl)methylene]carbamate CAS Name: (NZ)-N-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-(4-phenyl-1-piperazinyl)methylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NZ)-N-[[(2-methylpropan-2-yl)oxycarbonylamino]-(4-phenylpiperazin-1-yl)methylidene]carbamate Traditional Name: (NZ)-N-[(tert-butoxycarbonylamino)-(4-phenylpiperazino)methylene]carbamic acid tert-butyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NC(=O)OC(C)(C)C)N1CCN(CC1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N/C(=N/C(=O)OC(C)(C)C)/N1CCN(CC1)C2=CC=CC=C2

InChI

InChI=1S/C21H32N4O4/c1-20(2,3)28-18(26)22-17(23-19(27)29-21(4,5)6)25-14-12-24(13-15-25)16-10-8-7-9-11-16/h7-11H,12-15H2,1-6H3,(H,22,23,26,27)