2-[2,6-bis(fluoranyl)-3-propoxy-phenyl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-ethanamide

Systemtic Name: 2-[2,6-bis(fluoranyl)-3-propoxy-phenyl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-(2,6-difluoro-3-propoxy-phenyl)-2-ethoxy-acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-(2,6-difluoro-3-propoxyphenyl)-2-ethoxyacetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-(2,6-difluoro-3-propoxyphenyl)-2-ethoxyacetamide Traditional Name: N-(4-amidinobenzyl)-2-(2,6-difluoro-3-propoxy-phenyl)-2-ethoxy-acetamide Formula: C21H25F2N3O3 MolecularWeight: 405.438306

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(=C(C=C1)F)C(C(=O)NCC2=CC=C(C=C2)C(=N)N)OCC)F

Isomeric SMILES

CCCOC1=C(C(=C(C=C1)F)C(C(=O)NCC2=CC=C(C=C2)C(=N)N)OCC)F

InChI

InChI=1S/C21H25F2N3O3/c1-3-11-29-16-10-9-15(22)17(18(16)23)19(28-4-2)21(27)26-12-13-5-7-14(8-6-13)20(24)25/h5-10,19H,3-4,11-12H2,1-2H3,(H3,24,25)(H,26,27)