3-[1-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[1-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[1-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]-1,3-benzoxazol-2-one IUPAC Name: 3-[1-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazino]-2-keto-1-methyl-ethyl]-1,3-benzoxazol-2-one Formula: C23H25N3O7S MolecularWeight: 487.5255

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)N4C5=CC=CC=C5OC4=O

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)N4C5=CC=CC=C5OC4=O

InChI

InChI=1S/C23H25N3O7S/c1-16(26-18-5-2-3-6-19(18)33-23(26)28)22(27)24-9-11-25(12-10-24)34(29,30)17-7-8-20-21(15-17)32-14-4-13-31-20/h2-3,5-8,15-16H,4,9-14H2,1H3