(2-methoxy-5-nitro-phenyl)-[3-[(6-methoxypyridin-1-ium-3-yl)carbamoyl]phenyl]sulfonyl-azanide

Systemtic Name: (2-methoxy-5-nitro-phenyl)-[3-[(6-methoxypyridin-1-ium-3-yl)carbamoyl]phenyl]sulfonyl-azanide Openeye Name: (2-methoxy-5-nitro-phenyl)-[3-[(6-methoxypyridin-1-ium-3-yl)carbamoyl]phenyl]sulfonyl-azanide CAS Name: (2-methoxy-5-nitrophenyl)-[3-[[(6-methoxy-3-pyridin-1-iumyl)amino]-oxomethyl]phenyl]sulfonylazanide IUPAC Name: (2-methoxy-5-nitrophenyl)-[3-[(6-methoxypyridin-1-ium-3-yl)carbamoyl]phenyl]sulfonylazanide Traditional Name: (2-methoxy-5-nitro-phenyl)-[3-[(6-methoxypyridin-1-ium-3-yl)carbamoyl]phenyl]sulfonyl-azanide Formula: C20H18N4O7S MolecularWeight: 458.44452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])[N-]S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C[NH+]=C(C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])[N-]S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C[NH+]=C(C=C3)OC

InChI

InChI=1S/C20H17N4O7S/c1-30-18-8-7-15(24(26)27)11-17(18)23-32(28,29)16-5-3-4-13(10-16)20(25)22-14-6-9-19(31-2)21-12-14/h3-12H,1-2H3,(H,22,25)/q-1/p+1