[2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-5-nitro-phenyl] N-(3-methylbutyl)carbamate

Systemtic Name: [2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-5-nitro-phenyl] N-(3-methylbutyl)carbamate Openeye Name: [2-[2-[(tert-butoxycarbonylamino)methyl]phenyl]-5-nitro-phenyl] N-isopentylcarbamate CAS Name: N-(3-methylbutyl)carbamic acid [2-[2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]-5-nitrophenyl] ester IUPAC Name: [2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-5-nitrophenyl] N-(3-methylbutyl)carbamate Traditional Name: N-isoamylcarbamic acid [2-[2-[(tert-butoxycarbonylamino)methyl]phenyl]-5-nitro-phenyl] ester Formula: C24H31N3O6 MolecularWeight: 457.51944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)OC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=CC=C2CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCNC(=O)OC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=CC=C2CNC(=O)OC(C)(C)C

InChI

InChI=1S/C24H31N3O6/c1-16(2)12-13-25-22(28)32-21-14-18(27(30)31)10-11-20(21)19-9-7-6-8-17(19)15-26-23(29)33-24(3,4)5/h6-11,14,16H,12-13,15H2,1-5H3,(H,25,28)(H,26,29)