5-[[tert-butyl-[(4-fluorophenyl)methyl]amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[tert-butyl-[(4-fluorophenyl)methyl]amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[tert-butyl-[(4-fluorophenyl)methyl]amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[tert-butyl-[(4-fluorophenyl)methyl]amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[tert-butyl-[(4-fluorophenyl)methyl]amino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[tert-butyl-(4-fluorobenzyl)amino]methyl]-2-furoic acid Formula: C17H20FNO3 MolecularWeight: 305.344003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=C(C=C1)F)CC2=CC=C(O2)C(=O)O

Isomeric SMILES

CC(C)(C)N(CC1=CC=C(C=C1)F)CC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C17H20FNO3/c1-17(2,3)19(10-12-4-6-13(18)7-5-12)11-14-8-9-15(22-14)16(20)21/h4-9H,10-11H2,1-3H3,(H,20,21)