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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18FNO2/c1-12-6-7-15(14(18)10-12)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