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

Systemtic Name: 1-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]-1-piperidyl]-2-methyl-propan-1-one CAS Name: 1-[3-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-methyl-1-propanone IUPAC Name: 1-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]piperidin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]piperidino]-2-methyl-propan-1-one Formula: C23H33N3O6S MolecularWeight: 479.58962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H33N3O6S/c1-17(2)22(27)25-8-3-5-18(16-25)23(28)24-9-11-26(12-10-24)33(29,30)19-6-7-20-21(15-19)32-14-4-13-31-20/h6-7,15,17-18H,3-5,8-14,16H2,1-2H3