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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H26N2O6S/c1-31-21-9-11-22(12-10-21)34(29,30)27(17-19-6-3-2-4-7-19)18-25(28)26-20-8-13-23-24(16-20)33-15-5-14-32-23/h2-4,6-13,16H,5,14-15,17-18H2,1H3,(H,26,28)