3-[2-(7-chloranyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-oxidanylidene-ethyl]-4-(furan-3-ylmethyl)piperazin-2-one

Systemtic Name: 3-[2-(7-chloranyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-oxidanylidene-ethyl]-4-(furan-3-ylmethyl)piperazin-2-one Openeye Name: 3-[2-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-oxo-ethyl]-4-(3-furylmethyl)piperazin-2-one CAS Name: 3-[2-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-oxoethyl]-4-(3-furanylmethyl)-2-piperazinone IUPAC Name: 3-[2-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-oxoethyl]-4-(furan-3-ylmethyl)piperazin-2-one Traditional Name: 3-[2-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-keto-ethyl]-4-(3-furfuryl)piperazin-2-one Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)N2CCOC3=C(C2)C=C(C=C3)Cl)CC4=COC=C4

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)N2CCOC3=C(C2)C=C(C=C3)Cl)CC4=COC=C4

InChI

InChI=1S/C20H22ClN3O4/c21-16-1-2-18-15(9-16)12-24(6-8-28-18)19(25)10-17-20(26)22-4-5-23(17)11-14-3-7-27-13-14/h1-3,7,9,13,17H,4-6,8,10-12H2,(H,22,26)