2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)hex-5-enoic acid

Systemtic Name: 2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)hex-5-enoic acid Openeye Name: 2-(benzyloxycarbonylamino)-2-(trifluoromethyl)hex-5-enoic acid CAS Name: 2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)-5-hexenoic acid IUPAC Name: 2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)hex-5-enoic acid Traditional Name: 2-(benzyloxycarbonylamino)-2-(trifluoromethyl)hex-5-enoic acid Formula: C15H16F3NO4 MolecularWeight: 331.28705

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(C(=O)O)(C(F)(F)F)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

C=CCCC(C(=O)O)(C(F)(F)F)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H16F3NO4/c1-2-3-9-14(12(20)21,15(16,17)18)19-13(22)23-10-11-7-5-4-6-8-11/h2,4-8H,1,3,9-10H2,(H,19,22)(H,20,21)