N-(1,3-benzodioxol-5-ylmethyl)-1-(3-chloranyl-4-fluoranyl-phenyl)ethanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-chloranyl-4-fluoranyl-phenyl)ethanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-chloro-4-fluoro-phenyl)ethanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-chloro-4-fluorophenyl)ethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3-chloro-4-fluorophenyl)ethanamine Traditional Name: 1-(3-chloro-4-fluoro-phenyl)ethyl-piperonyl-amine Formula: C16H15ClFNO2 MolecularWeight: 307.747203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Cl)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)Cl)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H15ClFNO2/c1-10(12-3-4-14(18)13(17)7-12)19-8-11-2-5-15-16(6-11)21-9-20-15/h2-7,10,19H,8-9H2,1H3