[(4-carbamimidoylphenyl)amino] 2-[3-ethyl-2-(2-hydroxyethyloxy)-5-iodanyl-phenyl]ethanoate hydrochloride

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[3-ethyl-2-(2-hydroxyethyloxy)-5-iodanyl-phenyl]ethanoate hydrochloride Openeye Name: (4-carbamimidoylanilino) 2-[3-ethyl-2-(2-hydroxyethoxy)-5-iodo-phenyl]acetate hydrochloride CAS Name: 2-[3-ethyl-2-(2-hydroxyethoxy)-5-iodophenyl]acetic acid (4-carbamimidoylanilino) ester hydrochloride IUPAC Name: (4-carbamimidoylanilino) 2-[3-ethyl-2-(2-hydroxyethoxy)-5-iodophenyl]acetate hydrochloride Traditional Name: 2-[3-ethyl-2-(2-hydroxyethoxy)-5-iodo-phenyl]acetic acid (4-amidinoanilino) ester hydrochloride Formula: C19H23ClIN3O4 MolecularWeight: 519.76109

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)I)CC(=O)ONC2=CC=C(C=C2)C(=N)N)OCCO.Cl

Isomeric SMILES

CCC1=C(C(=CC(=C1)I)CC(=O)ONC2=CC=C(C=C2)C(=N)N)OCCO.Cl

InChI

InChI=1S/C19H22IN3O4.ClH/c1-2-12-9-15(20)10-14(18(12)26-8-7-24)11-17(25)27-23-16-5-3-13(4-6-16)19(21)22;/h3-6,9-10,23-24H,2,7-8,11H2,1H3,(H3,21,22);1H