2-(4-bromanyl-2-fluoranyl-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxy-ethanamide hydrochloride

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxy-ethanamide hydrochloride Openeye Name: 2-(4-bromo-2-fluoro-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxy-acetamide hydrochloride CAS Name: 2-(4-bromo-2-fluorophenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxyacetamide hydrochloride IUPAC Name: 2-(4-bromo-2-fluorophenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxyacetamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-2-(4-bromo-2-fluoro-phenyl)-2-propoxy-acetamide hydrochloride Formula: C19H22BrClFN3O2 MolecularWeight: 458.752283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=C(C=C(C=C1)Br)F)C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

CCCOC(C1=C(C=C(C=C1)Br)F)C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C19H21BrFN3O2.ClH/c1-2-9-26-17(15-8-7-14(20)10-16(15)21)19(25)24-11-12-3-5-13(6-4-12)18(22)23;/h3-8,10,17H,2,9,11H2,1H3,(H3,22,23)(H,24,25);1H