ethyl N-[1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonylamino]-4-methyl-pentan-2-yl]carbamate

Systemtic Name: ethyl N-[1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonylamino]-4-methyl-pentan-2-yl]carbamate Openeye Name: ethyl N-[1-[[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)amino]methyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethyl]amino]-4-methylpentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)amino]-4-methylpentan-2-yl]carbamate Traditional Name: N-[1-[[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)amino]methyl]-3-methyl-butyl]carbamic acid ethyl ester Formula: C19H27ClN2O5 MolecularWeight: 398.88108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)C1=CC2=C(C(=C1)Cl)OCCCO2

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)C1=CC2=C(C(=C1)Cl)OCCCO2

InChI

InChI=1S/C19H27ClN2O5/c1-4-25-19(24)22-14(8-12(2)3)11-21-18(23)13-9-15(20)17-16(10-13)26-6-5-7-27-17/h9-10,12,14H,4-8,11H2,1-3H3,(H,21,23)(H,22,24)