[4-[(4-methyl-3-nitro-phenyl)sulfonyl-phenoxycarbonyl-amino]phenyl] phenyl carbonate

Systemtic Name: [4-[(4-methyl-3-nitro-phenyl)sulfonyl-phenoxycarbonyl-amino]phenyl] phenyl carbonate Openeye Name: [4-[(4-methyl-3-nitro-phenyl)sulfonyl-phenoxycarbonyl-amino]phenyl] phenyl carbonate CAS Name: carbonic acid [4-[(4-methyl-3-nitrophenyl)sulfonyl-[oxo(phenoxy)methyl]amino]phenyl] phenyl ester IUPAC Name: [4-[(4-methyl-3-nitrophenyl)sulfonyl-phenoxycarbonylamino]phenyl] phenyl carbonate Traditional Name: carbonic acid [4-[carbophenoxy-(4-methyl-3-nitro-phenyl)sulfonyl-amino]phenyl] phenyl ester Formula: C27H20N2O9S MolecularWeight: 548.5207

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC(=O)OC3=CC=CC=C3)C(=O)OC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC(=O)OC3=CC=CC=C3)C(=O)OC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H20N2O9S/c1-19-12-17-24(18-25(19)29(32)33)39(34,35)28(26(30)36-21-8-4-2-5-9-21)20-13-15-23(16-14-20)38-27(31)37-22-10-6-3-7-11-22/h2-18H,1H3