methyl 2-[4-[2-(4-carbamimidoylphenyl)ethylcarbamoyl]phenoxy]ethanoate hydrochloride

Systemtic Name: methyl 2-[4-[2-(4-carbamimidoylphenyl)ethylcarbamoyl]phenoxy]ethanoate hydrochloride Openeye Name: methyl 2-[4-[2-(4-carbamimidoylphenyl)ethylcarbamoyl]phenoxy]acetate hydrochloride CAS Name: 2-[4-[[2-(4-carbamimidoylphenyl)ethylamino]-oxomethyl]phenoxy]acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-[4-[2-(4-carbamimidoylphenyl)ethylcarbamoyl]phenoxy]acetate hydrochloride Traditional Name: 2-[4-[2-(4-amidinophenyl)ethylcarbamoyl]phenoxy]acetic acid methyl ester hydrochloride Formula: C19H22ClN3O4 MolecularWeight: 391.84868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C(=O)NCCC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C(=O)NCCC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C19H21N3O4.ClH/c1-25-17(23)12-26-16-8-6-15(7-9-16)19(24)22-11-10-13-2-4-14(5-3-13)18(20)21;/h2-9H,10-12H2,1H3,(H3,20,21)(H,22,24);1H