2-[(4-carbamimidoylphenyl)amino]-2-[2-(2-hydroxyethyloxy)-5-propanoyl-phenyl]ethanoate hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[2-(2-hydroxyethyloxy)-5-propanoyl-phenyl]ethanoate hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-[2-(2-hydroxyethoxy)-5-propanoyl-phenyl]acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-2-[2-(2-hydroxyethoxy)-5-(1-oxopropyl)phenyl]acetate hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-2-[2-(2-hydroxyethoxy)-5-propanoylphenyl]acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-[2-(2-hydroxyethoxy)-5-propionyl-phenyl]acetate hydrochloride Formula: C20H23ClN3O5- MolecularWeight: 420.86672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O5.ClH/c1-2-16(25)13-5-8-17(28-10-9-24)15(11-13)18(20(26)27)23-14-6-3-12(4-7-14)19(21)22;/h3-8,11,18,23-24H,2,9-10H2,1H3,(H3,21,22)(H,26,27);1H/p-1