N-[3,5-bis(fluoranyl)phenyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: N-[3,5-bis(fluoranyl)phenyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: N-(3,5-difluorophenyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: N-(3,5-difluorophenyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: N-(3,5-difluorophenyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (3,5-difluorophenyl)-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amine Formula: C17H17F2NO MolecularWeight: 289.319786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NC3=CC(=CC(=C3)F)F

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C17H17F2NO/c1-11-4-2-5-15-16(6-3-7-21-17(11)15)20-14-9-12(18)8-13(19)10-14/h2,4-5,8-10,16,20H,3,6-7H2,1H3