N-[3,4-bis(fluoranyl)phenyl]-3,3-dimethyl-4H-isoquinolin-2-ium-1-amine

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-3,3-dimethyl-4H-isoquinolin-2-ium-1-amine Openeye Name: N-(3,4-difluorophenyl)-3,3-dimethyl-4H-isoquinolin-2-ium-1-amine CAS Name: N-(3,4-difluorophenyl)-3,3-dimethyl-4H-isoquinolin-2-ium-1-amine IUPAC Name: N-(3,4-difluorophenyl)-3,3-dimethyl-4H-isoquinolin-2-ium-1-amine Traditional Name: (3,4-difluorophenyl)-(3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)amine Formula: C17H17F2N2+ MolecularWeight: 287.327086

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=[NH+]1)NC3=CC(=C(C=C3)F)F)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=[NH+]1)NC3=CC(=C(C=C3)F)F)C

InChI

InChI=1S/C17H16F2N2/c1-17(2)10-11-5-3-4-6-13(11)16(21-17)20-12-7-8-14(18)15(19)9-12/h3-9H,10H2,1-2H3,(H,20,21)/p+1