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

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: N-(3,4-difluorophenyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: N-(3,4-difluorophenyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: N-(3,4-difluorophenyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (3,4-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(=C(C=C3)F)F

Isomeric SMILES

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

InChI

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