ethyl 4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)amino]piperidine-1-carboxylate CAS Name: 4-[[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H23ClN2O5 MolecularWeight: 382.83862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C18H23ClN2O5/c1-2-24-18(23)21-6-4-13(5-7-21)20-17(22)12-10-14(19)16-15(11-12)25-8-3-9-26-16/h10-11,13H,2-9H2,1H3,(H,20,22)