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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(C=CC(=C1F)OC(C)C)F)C(=O)NCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(C1=C(C=CC(=C1F)OC(C)C)F)C(=O)NCC2=CC=C(C=C2)C(=N)N

InChI

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