N-[(4-carbamimidoyl-3-chloranyl-phenyl)methyl]-2-ethoxy-2-(2-fluoranyl-4-methoxy-phenyl)ethanamide; ethanoic acid

Systemtic Name: N-[(4-carbamimidoyl-3-chloranyl-phenyl)methyl]-2-ethoxy-2-(2-fluoranyl-4-methoxy-phenyl)ethanamide; ethanoic acid Openeye Name: acetic acid; N-[(4-carbamimidoyl-3-chloro-phenyl)methyl]-2-ethoxy-2-(2-fluoro-4-methoxy-phenyl)acetamide CAS Name: acetic acid; N-[(4-carbamimidoyl-3-chlorophenyl)methyl]-2-ethoxy-2-(2-fluoro-4-methoxyphenyl)acetamide IUPAC Name: acetic acid; N-[(4-carbamimidoyl-3-chlorophenyl)methyl]-2-ethoxy-2-(2-fluoro-4-methoxyphenyl)acetamide Traditional Name: acetic acid; N-(4-amidino-3-chloro-benzyl)-2-ethoxy-2-(2-fluoro-4-methoxy-phenyl)acetamide Formula: C21H25ClFN3O5 MolecularWeight: 453.891703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClFN3O3.C2H4O2/c1-3-27-17(14-7-5-12(26-2)9-16(14)21)19(25)24-10-11-4-6-13(18(22)23)15(20)8-11;1-2(3)4/h4-9,17H,3,10H2,1-2H3,(H3,22,23)(H,24,25);1H3,(H,3,4)