[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]phenyl] 4-nitrobenzoate

Systemtic Name: [4-[(4-methoxyphenyl)sulfonyl-methyl-amino]phenyl] 4-nitrobenzoate Openeye Name: [4-[(4-methoxyphenyl)sulfonyl-methyl-amino]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(4-methoxyphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-methoxyphenyl)sulfonyl-methylamino]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(4-methoxyphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C21H18N2O7S MolecularWeight: 442.44182

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H18N2O7S/c1-22(31(27,28)20-13-11-18(29-2)12-14-20)16-7-9-19(10-8-16)30-21(24)15-3-5-17(6-4-15)23(25)26/h3-14H,1-2H3