N-[4-[5-(dimethylaminomethyl)-1,3-dihydroisoindol-2-yl]-4-oxidanylidene-butyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[4-[5-(dimethylaminomethyl)-1,3-dihydroisoindol-2-yl]-4-oxidanylidene-butyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide Openeye Name: N-[4-[5-(dimethylaminomethyl)isoindolin-2-yl]-4-oxo-butyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide CAS Name: N-[4-[5-(dimethylaminomethyl)-1,3-dihydroisoindol-2-yl]-4-oxobutyl]-4-methoxy-N,2,6-trimethylbenzenesulfonamide IUPAC Name: N-[4-[5-(dimethylaminomethyl)-1,3-dihydroisoindol-2-yl]-4-oxobutyl]-4-methoxy-N,2,6-trimethylbenzenesulfonamide Traditional Name: N-[4-[5-(dimethylaminomethyl)isoindolin-2-yl]-4-keto-butyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCCC(=O)N2CC3=C(C2)C=C(C=C3)CN(C)C)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCCC(=O)N2CC3=C(C2)C=C(C=C3)CN(C)C)C)OC

InChI

InChI=1S/C25H35N3O4S/c1-18-12-23(32-6)13-19(2)25(18)33(30,31)27(5)11-7-8-24(29)28-16-21-10-9-20(15-26(3)4)14-22(21)17-28/h9-10,12-14H,7-8,11,15-17H2,1-6H3