2-[(4-carbamimidoylphenyl)amino]-2-(3-ethoxy-5-oxidanyl-phenyl)ethanoate hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-ethoxy-5-oxidanyl-phenyl)ethanoate hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-(3-ethoxy-5-hydroxy-phenyl)acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-2-(3-ethoxy-5-hydroxyphenyl)acetate hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-ethoxy-5-hydroxyphenyl)acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-(3-ethoxy-5-hydroxy-phenyl)acetate hydrochloride Formula: C17H19ClN3O4- MolecularWeight: 364.80346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)O)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1)O)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C17H19N3O4.ClH/c1-2-24-14-8-11(7-13(21)9-14)15(17(22)23)20-12-5-3-10(4-6-12)16(18)19;/h3-9,15,20-21H,2H2,1H3,(H3,18,19)(H,22,23);1H/p-1