5-methoxy-4-(2-methoxyethoxy)-2-[(4-methoxy-3-nitro-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 5-methoxy-4-(2-methoxyethoxy)-2-[(4-methoxy-3-nitro-phenyl)sulfonylamino]benzoic acid Openeye Name: 5-methoxy-4-(2-methoxyethoxy)-2-[(4-methoxy-3-nitro-phenyl)sulfonylamino]benzoic acid CAS Name: 5-methoxy-4-(2-methoxyethoxy)-2-[(4-methoxy-3-nitrophenyl)sulfonylamino]benzoic acid IUPAC Name: 5-methoxy-4-(2-methoxyethoxy)-2-[(4-methoxy-3-nitrophenyl)sulfonylamino]benzoic acid Traditional Name: 5-methoxy-4-(2-methoxyethoxy)-2-[(4-methoxy-3-nitro-phenyl)sulfonylamino]benzoic acid Formula: C18H20N2O10S MolecularWeight: 456.4238

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])C(=O)O)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])C(=O)O)OC

InChI

InChI=1S/C18H20N2O10S/c1-27-6-7-30-17-10-13(12(18(21)22)9-16(17)29-3)19-31(25,26)11-4-5-15(28-2)14(8-11)20(23)24/h4-5,8-10,19H,6-7H2,1-3H3,(H,21,22)