N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-methyl-butan-1-amine

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-methyl-butan-1-amine Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-3-methyl-butan-1-amine CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-3-methyl-1-butanamine IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-3-methylbutan-1-amine Traditional Name: (2-chloro-4-fluoro-benzyl)-isoamyl-amine Formula: C12H17ClFN MolecularWeight: 229.721483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC1=C(C=C(C=C1)F)Cl

Isomeric SMILES

CC(C)CCNCC1=C(C=C(C=C1)F)Cl

InChI

InChI=1S/C12H17ClFN/c1-9(2)5-6-15-8-10-3-4-11(14)7-12(10)13/h3-4,7,9,15H,5-6,8H2,1-2H3