N-[(4-carbamimidoylphenyl)methyl]-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-3,3,3-trifluoro-2-methoxy-2-phenyl-propanamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-3,3,3-trifluoro-2-methoxy-2-phenylpropanamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-3,3,3-trifluoro-2-methoxy-2-phenylpropanamide Traditional Name: N-(4-amidinobenzyl)-3,3,3-trifluoro-2-methoxy-2-phenyl-propionamide Formula: C18H18F3N3O2 MolecularWeight: 365.34963

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)(C(=O)NCC2=CC=C(C=C2)C(=N)N)C(F)(F)F

Isomeric SMILES

COC(C1=CC=CC=C1)(C(=O)NCC2=CC=C(C=C2)C(=N)N)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O2/c1-26-17(18(19,20)21,14-5-3-2-4-6-14)16(25)24-11-12-7-9-13(10-8-12)15(22)23/h2-10H,11H2,1H3,(H3,22,23)(H,24,25)