1-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]carbonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]carbonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]phenyl]-2-pyrrolidone Formula: C24H27N3O6S MolecularWeight: 485.55268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C24H27N3O6S/c28-23-3-1-10-27(23)19-6-4-18(5-7-19)24(29)25-11-13-26(14-12-25)34(30,31)20-8-9-21-22(17-20)33-16-2-15-32-21/h4-9,17H,1-3,10-16H2