4-chloranyl-2-nitro-6-[[(1S)-1-(4-sulfamoylphenyl)ethyl]iminomethyl]phenolate

Systemtic Name: 4-chloranyl-2-nitro-6-[[(1S)-1-(4-sulfamoylphenyl)ethyl]iminomethyl]phenolate Openeye Name: 4-chloro-2-nitro-6-[[(1S)-1-(4-sulfamoylphenyl)ethyl]iminomethyl]phenolate CAS Name: 4-chloro-2-nitro-6-[[(1S)-1-(4-sulfamoylphenyl)ethyl]iminomethyl]phenolate IUPAC Name: 4-chloro-2-nitro-6-[[(1S)-1-(4-sulfamoylphenyl)ethyl]iminomethyl]phenolate Traditional Name: 4-chloro-2-nitro-6-[[(1S)-1-(4-sulfamoylphenyl)ethyl]iminomethyl]phenolate Formula: C15H13ClN3O5S- MolecularWeight: 382.79882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)N)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H14ClN3O5S/c1-9(10-2-4-13(5-3-10)25(17,23)24)18-8-11-6-12(16)7-14(15(11)20)19(21)22/h2-9,20H,1H3,(H2,17,23,24)/p-1/t9-/m0/s1