N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-5-morpholinosulfonyl-benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-5-morpholinosulfonyl-benzamide Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H24N2O7S/c1-27-18-6-4-16(31(25,26)23-7-11-28-12-8-23)14-17(18)21(24)22-15-3-5-19-20(13-15)30-10-2-9-29-19/h3-6,13-14H,2,7-12H2,1H3,(H,22,24)