N-[3-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[3-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-3-oxo-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-[4-(1,3-benzoxazol-2-yl)piperidino]-3-keto-propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C24H27N3O6S MolecularWeight: 485.55268

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4)OC1

InChI

InChI=1S/C24H27N3O6S/c28-23(27-12-9-17(10-13-27)24-26-19-4-1-2-5-20(19)33-24)8-11-25-34(29,30)18-6-7-21-22(16-18)32-15-3-14-31-21/h1-2,4-7,16-17,25H,3,8-15H2