[4-[(4-acetamidophenyl)iminomethyl]phenyl] 3-nitrobenzenesulfonate

Systemtic Name: [4-[(4-acetamidophenyl)iminomethyl]phenyl] 3-nitrobenzenesulfonate Openeye Name: [4-[(4-acetamidophenyl)iminomethyl]phenyl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [4-[(4-acetamidophenyl)iminomethyl]phenyl] ester IUPAC Name: [4-[(4-acetamidophenyl)iminomethyl]phenyl] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [4-[(4-acetamidophenyl)iminomethyl]phenyl] ester Formula: C21H17N3O6S MolecularWeight: 439.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O6S/c1-15(25)23-18-9-7-17(8-10-18)22-14-16-5-11-20(12-6-16)30-31(28,29)21-4-2-3-19(13-21)24(26)27/h2-14H,1H3,(H,23,25)