4-nitro-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]iminomethyl]phenolate

Systemtic Name: 4-nitro-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]iminomethyl]phenolate Openeye Name: 4-nitro-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]iminomethyl]phenolate CAS Name: 4-nitro-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]iminomethyl]phenolate IUPAC Name: 4-nitro-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]iminomethyl]phenolate Traditional Name: 2-[[4-(mesitylsulfamoyl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C22H20N3O5S- MolecularWeight: 438.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C

InChI

InChI=1S/C22H21N3O5S/c1-14-10-15(2)22(16(3)11-14)24-31(29,30)20-7-4-18(5-8-20)23-13-17-12-19(25(27)28)6-9-21(17)26/h4-13,24,26H,1-3H3/p-1