N-(3-carbamimidoylphenyl)-N-methoxy-5-phenyl-pentanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-(3-carbamimidoylphenyl)-N-methoxy-5-phenyl-pentanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-(3-carbamimidoylphenyl)-N-methoxy-5-phenyl-pentanamide; 2,2,2-trifluoroacetic acid CAS Name: N-(3-carbamimidoylphenyl)-N-methoxy-5-phenylpentanamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-(3-carbamimidoylphenyl)-N-methoxy-5-phenylpentanamide; 2,2,2-trifluoroacetic acid Traditional Name: N-(3-amidinophenyl)-N-methoxy-5-phenyl-valeramide; 2,2,2-trifluoroacetic acid Formula: C23H25F6N3O6 MolecularWeight: 553.451519

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Descriptors Computed from Structure

Canonical SMILES:

CON(C1=CC=CC(=C1)C(=N)N)C(=O)CCCCC2=CC=CC=C2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CON(C1=CC=CC(=C1)C(=N)N)C(=O)CCCCC2=CC=CC=C2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H23N3O2.2C2HF3O2/c1-24-22(17-12-7-11-16(14-17)19(20)21)18(23)13-6-5-10-15-8-3-2-4-9-15;2*3-2(4,5)1(6)7/h2-4,7-9,11-12,14H,5-6,10,13H2,1H3,(H3,20,21);2*(H,6,7)