N-(5-chloranyl-2-morpholin-4-yl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4)OC1

InChI

InChI=1S/C19H21ClN2O5S/c20-14-2-4-17(22-6-10-25-11-7-22)16(12-14)21-28(23,24)15-3-5-18-19(13-15)27-9-1-8-26-18/h2-5,12-13,21H,1,6-11H2