N-[[2-(2-azanyl-2-oxidanylidene-ethoxy)-4-carbamimidoyl-phenyl]methyl]-3-fluoranyl-benzamide hydrochloride

Systemtic Name: N-[[2-(2-azanyl-2-oxidanylidene-ethoxy)-4-carbamimidoyl-phenyl]methyl]-3-fluoranyl-benzamide hydrochloride Openeye Name: N-[[2-(2-amino-2-oxo-ethoxy)-4-carbamimidoyl-phenyl]methyl]-3-fluoro-benzamide hydrochloride CAS Name: N-[[2-(2-amino-2-oxoethoxy)-4-carbamimidoylphenyl]methyl]-3-fluorobenzamide hydrochloride IUPAC Name: N-[[2-(2-amino-2-oxoethoxy)-4-carbamimidoylphenyl]methyl]-3-fluorobenzamide hydrochloride Traditional Name: N-[4-amidino-2-(2-amino-2-keto-ethoxy)benzyl]-3-fluoro-benzamide hydrochloride Formula: C17H18ClFN4O3 MolecularWeight: 380.801223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN4O3.ClH/c18-13-3-1-2-11(6-13)17(24)22-8-12-5-4-10(16(20)21)7-14(12)25-9-15(19)23;/h1-7H,8-9H2,(H2,19,23)(H3,20,21)(H,22,24);1H