[4-[methyl(phenylsulfonyl)amino]phenyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [4-[methyl(phenylsulfonyl)amino]phenyl] 3-methyl-4-nitro-benzoate Openeye Name: [4-[benzenesulfonyl(methyl)amino]phenyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [4-[benzenesulfonyl(methyl)amino]phenyl] ester IUPAC Name: [4-[benzenesulfonyl(methyl)amino]phenyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [4-[besyl(methyl)amino]phenyl] ester Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6S/c1-15-14-16(8-13-20(15)23(25)26)21(24)29-18-11-9-17(10-12-18)22(2)30(27,28)19-6-4-3-5-7-19/h3-14H,1-2H3