[3-(1H-benzimidazol-2-yl)-5-ethoxy-phenyl] 2-[(4-carbamimidoylphenyl)amino]ethanoate hydrochloride

Systemtic Name: [3-(1H-benzimidazol-2-yl)-5-ethoxy-phenyl] 2-[(4-carbamimidoylphenyl)amino]ethanoate hydrochloride Openeye Name: [3-(1H-benzimidazol-2-yl)-5-ethoxy-phenyl] 2-(4-carbamimidoylanilino)acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)acetic acid [3-(1H-benzimidazol-2-yl)-5-ethoxyphenyl] ester hydrochloride IUPAC Name: [3-(1H-benzimidazol-2-yl)-5-ethoxyphenyl] 2-(4-carbamimidoylanilino)acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)acetic acid [3-(1H-benzimidazol-2-yl)-5-ethoxy-phenyl] ester hydrochloride Formula: C24H24ClN5O3 MolecularWeight: 465.93206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)OC(=O)CNC2=CC=C(C=C2)C(=N)N)C3=NC4=CC=CC=C4N3.Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1)OC(=O)CNC2=CC=C(C=C2)C(=N)N)C3=NC4=CC=CC=C4N3.Cl

InChI

InChI=1S/C24H23N5O3.ClH/c1-2-31-18-11-16(24-28-20-5-3-4-6-21(20)29-24)12-19(13-18)32-22(30)14-27-17-9-7-15(8-10-17)23(25)26;/h3-13,27H,2,14H2,1H3,(H3,25,26)(H,28,29);1H