N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-methoxy-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methoxy-N-tosyl-anilino)acetamide Formula: C25H26N2O6S MolecularWeight: 482.54874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC3=C(C=C2)OCCCO3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC3=C(C=C2)OCCCO3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H26N2O6S/c1-18-8-11-20(12-9-18)34(29,30)27(21-6-3-4-7-22(21)31-2)17-25(28)26-19-10-13-23-24(16-19)33-15-5-14-32-23/h3-4,6-13,16H,5,14-15,17H2,1-2H3,(H,26,28)