2-[(4-carbamimidoylphenyl)amino]-2-(3-methyl-5-propan-2-yloxy-phenyl)ethanoate hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-methyl-5-propan-2-yloxy-phenyl)ethanoate hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-(3-isopropoxy-5-methyl-phenyl)acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-2-(3-methyl-5-propan-2-yloxyphenyl)acetate hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-methyl-5-propan-2-yloxyphenyl)acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-(3-isopropoxy-5-methyl-phenyl)acetate hydrochloride Formula: C19H23ClN3O3- MolecularWeight: 376.85722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(C)C)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)OC(C)C)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C19H23N3O3.ClH/c1-11(2)25-16-9-12(3)8-14(10-16)17(19(23)24)22-15-6-4-13(5-7-15)18(20)21;/h4-11,17,22H,1-3H3,(H3,20,21)(H,23,24);1H/p-1