tert-butyl 4-fluoranyl-3-[[(phenylmethyl)amino]methyl]benzoate

Systemtic Name: tert-butyl 4-fluoranyl-3-[[(phenylmethyl)amino]methyl]benzoate Openeye Name: tert-butyl 3-[(benzylamino)methyl]-4-fluoro-benzoate CAS Name: 4-fluoro-3-[[(phenylmethyl)amino]methyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(benzylamino)methyl]-4-fluorobenzoate Traditional Name: 3-[(benzylamino)methyl]-4-fluoro-benzoic acid tert-butyl ester Formula: C19H22FNO2 MolecularWeight: 315.381883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)F)CNCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)F)CNCC2=CC=CC=C2

InChI

InChI=1S/C19H22FNO2/c1-19(2,3)23-18(22)15-9-10-17(20)16(11-15)13-21-12-14-7-5-4-6-8-14/h4-11,21H,12-13H2,1-3H3