[4-[(2-butan-2-ylphenoxy)methyl]-3-fluoranyl-phenyl]methanamine

Systemtic Name: [4-[(2-butan-2-ylphenoxy)methyl]-3-fluoranyl-phenyl]methanamine Openeye Name: [3-fluoro-4-[(2-sec-butylphenoxy)methyl]phenyl]methanamine CAS Name: [4-[(2-butan-2-ylphenoxy)methyl]-3-fluorophenyl]methanamine IUPAC Name: [4-[(2-butan-2-ylphenoxy)methyl]-3-fluorophenyl]methanamine Traditional Name: [3-fluoro-4-[(2-sec-butylphenoxy)methyl]benzyl]amine Formula: C18H22FNO MolecularWeight: 287.371783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC2=C(C=C(C=C2)CN)F

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC2=C(C=C(C=C2)CN)F

InChI

InChI=1S/C18H22FNO/c1-3-13(2)16-6-4-5-7-18(16)21-12-15-9-8-14(11-20)10-17(15)19/h4-10,13H,3,11-12,20H2,1-2H3