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3-(4-carbamimidoylphenyl)-2-[3-(trifluoromethyl)phenyl]propanoic acid

3-(4-carbamimidoylphenyl)-2-[3-(trifluoromethyl)phenyl]propanoic acid

Systemtic Name:3-(4-carbamimidoylphenyl)-2-[3-(trifluoromethyl)phenyl]propanoic acid
Openeye Name:3-(4-carbamimidoylphenyl)-2-[3-(trifluoromethyl)phenyl]propanoic acid
CAS Name:3-(4-carbamimidoylphenyl)-2-[3-(trifluoromethyl)phenyl]propanoic acid
IUPAC Name:3-(4-carbamimidoylphenyl)-2-[3-(trifluoromethyl)phenyl]propanoic acid
Traditional Name:3-(4-amidinophenyl)-2-[3-(trifluoromethyl)phenyl]propionic acid
Formula: C17H15F3N2O2
MolecularWeight: 336.30841
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(CC2=CC=C(C=C2)C(=N)N)C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(CC2=CC=C(C=C2)C(=N)N)C(=O)O


InChI

InChI=1S/C17H15F3N2O2/c18-17(19,20)13-3-1-2-12(9-13)14(16(23)24)8-10-4-6-11(7-5-10)15(21)22/h1-7,9,14H,8H2,(H3,21,22)(H,23,24)


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