N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-4-nitro-benzenesulfonamide Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6S/c1-28-21-13-17(7-12-20(21)29-15-16-5-3-2-4-6-16)14-22-30(26,27)19-10-8-18(9-11-19)23(24)25/h2-13,22H,14-15H2,1H3