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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methoxy-3-morpholinosulfonyl-anilino)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[4-methoxy-3-(4-morpholinylsulfonyl)anilino]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methoxy-3-morpholin-4-ylsulfonylanilino)acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methoxy-3-morpholinosulfonyl-anilino)acetamide Formula: C22H27N3O7S MolecularWeight: 477.53068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NCC(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H27N3O7S/c1-29-19-6-3-16(14-21(19)33(27,28)25-7-11-30-12-8-25)23-15-22(26)24-17-4-5-18-20(13-17)32-10-2-9-31-18/h3-6,13-14,23H,2,7-12,15H2,1H3,(H,24,26)