1-(4-methylphenyl)sulfonyl-4-[2-[(4-methylphenyl)sulfonylmethoxy]ethyl]-1,4-diazepan-5-one

Systemtic Name: 1-(4-methylphenyl)sulfonyl-4-[2-[(4-methylphenyl)sulfonylmethoxy]ethyl]-1,4-diazepan-5-one Openeye Name: 1-(p-tolylsulfonyl)-4-[2-(p-tolylsulfonylmethoxy)ethyl]-1,4-diazepan-5-one CAS Name: 1-(4-methylphenyl)sulfonyl-4-[2-[(4-methylphenyl)sulfonylmethoxy]ethyl]-1,4-diazepan-5-one IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-[2-[(4-methylphenyl)sulfonylmethoxy]ethyl]-1,4-diazepan-5-one Traditional Name: 1-tosyl-4-[2-(tosylmethoxy)ethyl]-1,4-diazepan-5-one Formula: C22H28N2O6S2 MolecularWeight: 480.59752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)COCCN2CCN(CCC2=O)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)COCCN2CCN(CCC2=O)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H28N2O6S2/c1-18-3-7-20(8-4-18)31(26,27)17-30-16-15-23-13-14-24(12-11-22(23)25)32(28,29)21-9-5-19(2)6-10-21/h3-10H,11-17H2,1-2H3