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

Systemtic Name: 2-[4-bromanyl-2,6-bis(fluoranyl)phenyl]-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-ethanamide Openeye Name: 2-(4-bromo-2,6-difluoro-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-acetamide CAS Name: 2-(4-bromo-2,6-difluorophenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxyacetamide IUPAC Name: 2-(4-bromo-2,6-difluorophenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxyacetamide Traditional Name: N-(4-amidinobenzyl)-2-(4-bromo-2,6-difluoro-phenyl)-2-ethoxy-acetamide Formula: C18H18BrF2N3O2 MolecularWeight: 426.255226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrF2N3O2/c1-2-26-16(15-13(20)7-12(19)8-14(15)21)18(25)24-9-10-3-5-11(6-4-10)17(22)23/h3-8,16H,2,9H2,1H3,(H3,22,23)(H,24,25)