N-[1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-2-chloranyl-benzamide

Systemtic Name: N-[1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-2-chloranyl-benzamide Openeye Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-2-chloro-benzamide CAS Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-2-chlorobenzamide IUPAC Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-2-chlorobenzamide Traditional Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-2-chloro-benzamide Formula: C18H17BrClNO3 MolecularWeight: 410.68948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1Br)OCCCO2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C1=CC2=C(C=C1Br)OCCCO2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H17BrClNO3/c1-11(21-18(22)12-5-2-3-6-15(12)20)13-9-16-17(10-14(13)19)24-8-4-7-23-16/h2-3,5-6,9-11H,4,7-8H2,1H3,(H,21,22)