N-[[2-(2-acetamidoethoxy)-4-carbamimidoyl-phenyl]methyl]-4-fluoranyl-3-methyl-benzamide hydrochloride

Systemtic Name: N-[[2-(2-acetamidoethoxy)-4-carbamimidoyl-phenyl]methyl]-4-fluoranyl-3-methyl-benzamide hydrochloride Openeye Name: N-[[2-(2-acetamidoethoxy)-4-carbamimidoyl-phenyl]methyl]-4-fluoro-3-methyl-benzamide hydrochloride CAS Name: N-[[2-(2-acetamidoethoxy)-4-carbamimidoylphenyl]methyl]-4-fluoro-3-methylbenzamide hydrochloride IUPAC Name: N-[[2-(2-acetamidoethoxy)-4-carbamimidoylphenyl]methyl]-4-fluoro-3-methylbenzamide hydrochloride Traditional Name: N-[2-(2-acetamidoethoxy)-4-amidino-benzyl]-4-fluoro-3-methyl-benzamide hydrochloride Formula: C20H24ClFN4O3 MolecularWeight: 422.880963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCCNC(=O)C)F.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCCNC(=O)C)F.Cl

InChI

InChI=1S/C20H23FN4O3.ClH/c1-12-9-15(5-6-17(12)21)20(27)25-11-16-4-3-14(19(22)23)10-18(16)28-8-7-24-13(2)26;/h3-6,9-10H,7-8,11H2,1-2H3,(H3,22,23)(H,24,26)(H,25,27);1H