5-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,3-dihydro-1,5-benzoxazepin-4-one

Systemtic Name: 5-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,3-dihydro-1,5-benzoxazepin-4-one Openeye Name: 5-[2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-oxo-ethyl]-2,3-dihydro-1,5-benzoxazepin-4-one CAS Name: 5-[2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-oxoethyl]-2,3-dihydro-1,5-benzoxazepin-4-one IUPAC Name: 5-[2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-oxoethyl]-2,3-dihydro-1,5-benzoxazepin-4-one Traditional Name: 5-[2-[4-(5-bromo-2-pyridyl)piperazino]-2-keto-ethyl]-2,3-dihydro-1,5-benzoxazepin-4-one Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C20H21BrN4O3/c21-15-5-6-18(22-13-15)23-8-10-24(11-9-23)20(27)14-25-16-3-1-2-4-17(16)28-12-7-19(25)26/h1-6,13H,7-12,14H2