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

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-ethyl-butanamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-ethyl-butanamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-ethylbutanamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-ethylbutanamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-ethyl-butyramide Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NCC1=CC2=C(C(=C1)Cl)OCCCO2

Isomeric SMILES

CCC(CC)C(=O)NCC1=CC2=C(C(=C1)Cl)OCCCO2

InChI

InChI=1S/C16H22ClNO3/c1-3-12(4-2)16(19)18-10-11-8-13(17)15-14(9-11)20-6-5-7-21-15/h8-9,12H,3-7,10H2,1-2H3,(H,18,19)