methyl 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-3-nitrophenyl)sulfonylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C16H15ClN2O8S MolecularWeight: 430.8169

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C16H15ClN2O8S/c1-25-14-7-10(16(20)27-3)12(8-15(14)26-2)18-28(23,24)9-4-5-11(17)13(6-9)19(21)22/h4-8,18H,1-3H3