tert-butyl 2-fluoranylbenzoate; N-[(2-phenylmethoxyphenyl)methyl]ethanamine

Systemtic Name: tert-butyl 2-fluoranylbenzoate; N-[(2-phenylmethoxyphenyl)methyl]ethanamine Openeye Name: N-[(2-benzyloxyphenyl)methyl]ethanamine; tert-butyl 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid tert-butyl ester; N-[(2-phenylmethoxyphenyl)methyl]ethanamine IUPAC Name: tert-butyl 2-fluorobenzoate; N-[(2-phenylmethoxyphenyl)methyl]ethanamine Traditional Name: (2-benzoxybenzyl)-ethyl-amine; 2-fluorobenzoic acid tert-butyl ester Formula: C27H32FNO3 MolecularWeight: 437.546283

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC=CC=C1OCC2=CC=CC=C2.CC(C)(C)OC(=O)C1=CC=CC=C1F

Isomeric SMILES

CCNCC1=CC=CC=C1OCC2=CC=CC=C2.CC(C)(C)OC(=O)C1=CC=CC=C1F

InChI

InChI=1S/C16H19NO.C11H13FO2/c1-2-17-12-15-10-6-7-11-16(15)18-13-14-8-4-3-5-9-14;1-11(2,3)14-10(13)8-6-4-5-7-9(8)12/h3-11,17H,2,12-13H2,1H3;4-7H,1-3H3