(2-methanoyl-6-methoxy-3-nitro-phenyl) benzenesulfonate; 3-methoxy-2-(phenylsulfonyl)benzaldehyde

Systemtic Name: (2-methanoyl-6-methoxy-3-nitro-phenyl) benzenesulfonate; 3-methoxy-2-(phenylsulfonyl)benzaldehyde Openeye Name: 2-(benzenesulfonyl)-3-methoxy-benzaldehyde; (2-formyl-6-methoxy-3-nitro-phenyl) benzenesulfonate CAS Name: benzenesulfonic acid (2-formyl-6-methoxy-3-nitrophenyl) ester; 2-(benzenesulfonyl)-3-methoxybenzaldehyde IUPAC Name: 2-(benzenesulfonyl)-3-methoxybenzaldehyde; (2-formyl-6-methoxy-3-nitrophenyl) benzenesulfonate Traditional Name: benzenesulfonic acid (2-formyl-6-methoxy-3-nitro-phenyl) ester; 2-besyl-3-methoxy-benzaldehyde Formula: C28H23NO11S2 MolecularWeight: 613.61232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)OS(=O)(=O)C2=CC=CC=C2.COC1=CC=CC(=C1S(=O)(=O)C2=CC=CC=C2)C=O

Isomeric SMILES

COC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)OS(=O)(=O)C2=CC=CC=C2.COC1=CC=CC(=C1S(=O)(=O)C2=CC=CC=C2)C=O

InChI

InChI=1S/C14H11NO7S.C14H12O4S/c1-21-13-8-7-12(15(17)18)11(9-16)14(13)22-23(19,20)10-5-3-2-4-6-10;1-18-13-9-5-6-11(10-15)14(13)19(16,17)12-7-3-2-4-8-12/h2-9H,1H3;2-10H,1H3