N-(3-acetamido-4-methoxy-phenyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]ethanamide

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]ethanamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)OC

InChI

InChI=1S/C21H25N3O7S/c1-14(25)22-17-11-15(5-7-18(17)29-3)23-21(26)13-24(2)32(27,28)16-6-8-19-20(12-16)31-10-4-9-30-19/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,22,25)(H,23,26)