2-[(4-carbamimidoylphenyl)amino]-2-[3-(2-hydroxyethyloxy)-4-propan-2-yloxy-phenyl]ethanoate hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[3-(2-hydroxyethyloxy)-4-propan-2-yloxy-phenyl]ethanoate hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-[3-(2-hydroxyethoxy)-4-isopropoxy-phenyl]acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-2-[3-(2-hydroxyethoxy)-4-propan-2-yloxyphenyl]acetate hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-2-[3-(2-hydroxyethoxy)-4-propan-2-yloxyphenyl]acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-[3-(2-hydroxyethoxy)-4-isopropoxy-phenyl]acetate hydrochloride Formula: C20H25ClN3O5- MolecularWeight: 422.8826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N)OCCO.Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N)OCCO.Cl

InChI

InChI=1S/C20H25N3O5.ClH/c1-12(2)28-16-8-5-14(11-17(16)27-10-9-24)18(20(25)26)23-15-6-3-13(4-7-15)19(21)22;/h3-8,11-12,18,23-24H,9-10H2,1-2H3,(H3,21,22)(H,25,26);1H/p-1