(2S)-5-(2-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoic acid

Systemtic Name: (2S)-5-(2-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-5-(2-fluorophenyl)pent-4-ynoic acid CAS Name: (2S)-5-(2-fluorophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-pentynoic acid IUPAC Name: (2S)-5-(2-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-(2-fluorophenyl)pent-4-ynoic acid Formula: C16H18FNO4 MolecularWeight: 307.316823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#CC1=CC=CC=C1F)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC#CC1=CC=CC=C1F)C(=O)O

InChI

InChI=1S/C16H18FNO4/c1-16(2,3)22-15(21)18-13(14(19)20)10-6-8-11-7-4-5-9-12(11)17/h4-5,7,9,13H,10H2,1-3H3,(H,18,21)(H,19,20)/t13-/m0/s1