2-azanyl-2-[bis(fluoranyl)methyl]-5-(3-phenylpropoxycarbonylamino)pentanoic acid

Systemtic Name: 2-azanyl-2-[bis(fluoranyl)methyl]-5-(3-phenylpropoxycarbonylamino)pentanoic acid Openeye Name: 2-amino-2-(difluoromethyl)-5-(3-phenylpropoxycarbonylamino)pentanoic acid CAS Name: 2-amino-2-(difluoromethyl)-5-[[oxo(3-phenylpropoxy)methyl]amino]pentanoic acid IUPAC Name: 2-amino-2-(difluoromethyl)-5-(3-phenylpropoxycarbonylamino)pentanoic acid Traditional Name: 2-amino-2-(difluoromethyl)-5-(3-phenylpropoxycarbonylamino)valeric acid Formula: C16H22F2N2O4 MolecularWeight: 344.353686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)NCCCC(C(F)F)(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)NCCCC(C(F)F)(C(=O)O)N

InChI

InChI=1S/C16H22F2N2O4/c17-13(18)16(19,14(21)22)9-5-10-20-15(23)24-11-4-8-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11,19H2,(H,20,23)(H,21,22)