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

Systemtic Name: N-[1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-3-chloranyl-benzamide Openeye Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-3-chloro-benzamide CAS Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-3-chlorobenzamide IUPAC Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-3-chlorobenzamide Traditional Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-3-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=C3)Cl

Isomeric SMILES

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

InChI

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