N-[2-(4-ethoxy-3-methoxy-phenyl)ethyl]-3-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: N-[2-(4-ethoxy-3-methoxy-phenyl)ethyl]-3-(phenylsulfonyl)benzenesulfonamide Openeye Name: 3-(benzenesulfonyl)-N-[2-(4-ethoxy-3-methoxy-phenyl)ethyl]benzenesulfonamide CAS Name: 3-(benzenesulfonyl)-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]benzenesulfonamide IUPAC Name: 3-(benzenesulfonyl)-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]benzenesulfonamide Traditional Name: 3-besyl-N-[2-(4-ethoxy-3-methoxy-phenyl)ethyl]benzenesulfonamide Formula: C23H25NO6S2 MolecularWeight: 475.5777

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H25NO6S2/c1-3-30-22-13-12-18(16-23(22)29-2)14-15-24-32(27,28)21-11-7-10-20(17-21)31(25,26)19-8-5-4-6-9-19/h4-13,16-17,24H,3,14-15H2,1-2H3