methyl 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxy-benzoate

Systemtic Name: methyl 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxy-benzoate Openeye Name: methyl 3-[(E)-dimethylaminomethyleneamino]sulfonyl-5-nitro-4-phenoxy-benzoate CAS Name: 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoic acid methyl ester IUPAC Name: methyl 3-[(E)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate Traditional Name: 3-[(E)-dimethylaminomethyleneamino]sulfonyl-5-nitro-4-phenoxy-benzoic acid methyl ester Formula: C17H17N3O7S MolecularWeight: 407.39778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NS(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN(C)/C=N/S(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H17N3O7S/c1-19(2)11-18-28(24,25)15-10-12(17(21)26-3)9-14(20(22)23)16(15)27-13-7-5-4-6-8-13/h4-11H,1-3H3/b18-11+