(phenylmethyl) N-[(4-nitrophenyl)-(phenylmethoxycarbonylamino)methyl]carbamate

Systemtic Name: (phenylmethyl) N-[(4-nitrophenyl)-(phenylmethoxycarbonylamino)methyl]carbamate Openeye Name: benzyl N-[benzyloxycarbonylamino-(4-nitrophenyl)methyl]carbamate CAS Name: N-[(4-nitrophenyl)-(phenylmethoxycarbonylamino)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(4-nitrophenyl)-(phenylmethoxycarbonylamino)methyl]carbamate Traditional Name: N-[benzyloxycarbonylamino-(4-nitrophenyl)methyl]carbamic acid benzyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O6/c27-22(31-15-17-7-3-1-4-8-17)24-21(19-11-13-20(14-12-19)26(29)30)25-23(28)32-16-18-9-5-2-6-10-18/h1-14,21H,15-16H2,(H,24,27)(H,25,28)