4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]piperazin-2-one

Systemtic Name: 4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]piperazin-2-one Openeye Name: 4-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)piperazin-2-one CAS Name: 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethyl]-2-piperazinone IUPAC Name: 4-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)piperazin-2-one Traditional Name: 4-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)piperazin-2-one Formula: C14H15ClN2O4 MolecularWeight: 310.7329

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)N3CCNC(=O)C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)N3CCNC(=O)C3)Cl)OC1

InChI

InChI=1S/C14H15ClN2O4/c15-10-6-9(7-11-13(10)21-5-1-4-20-11)14(19)17-3-2-16-12(18)8-17/h6-7H,1-5,8H2,(H,16,18)