1-[4-[[4-(1-ethylpiperidin-2-yl)carbonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[[4-(1-ethylpiperidin-2-yl)carbonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[[4-(1-ethylpiperidine-2-carbonyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[4-[(1-ethyl-2-piperidinyl)-oxomethyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[[4-(1-ethylpiperidine-2-carbonyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[[4-(1-ethylpipecoloyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperazino]ethanone Formula: C24H36N4O3 MolecularWeight: 428.56764

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCCC1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCN(CC4)C(=O)C

Isomeric SMILES

CCN1CCCCC1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCN(CC4)C(=O)C

InChI

InChI=1S/C24H36N4O3/c1-3-26-9-5-4-6-22(26)24(30)28-14-15-31-23-8-7-20(16-21(23)18-28)17-25-10-12-27(13-11-25)19(2)29/h7-8,16,22H,3-6,9-15,17-18H2,1-2H3