N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-5-fluoranyl-2-methyl-aniline

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-5-fluoranyl-2-methyl-aniline Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-5-fluoro-2-methyl-aniline CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-5-fluoro-2-methylaniline IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-5-fluoro-2-methylaniline Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl-(5-fluoro-2-methyl-phenyl)amine Formula: C17H18FNO2 MolecularWeight: 287.328723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NCC2=C3C(=CC=C2)OCCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)F)NCC2=C3C(=CC=C2)OCCCO3

InChI

InChI=1S/C17H18FNO2/c1-12-6-7-14(18)10-15(12)19-11-13-4-2-5-16-17(13)21-9-3-8-20-16/h2,4-7,10,19H,3,8-9,11H2,1H3