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

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[3-(methoxymethyl)-4-propan-2-yloxy-phenyl]ethanoate hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-[4-isopropoxy-3-(methoxymethyl)phenyl]acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-2-[3-(methoxymethyl)-4-propan-2-yloxyphenyl]acetate hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-2-[3-(methoxymethyl)-4-propan-2-yloxyphenyl]acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-[4-isopropoxy-3-(methoxymethyl)phenyl]acetate hydrochloride Formula: C20H25ClN3O4- MolecularWeight: 406.8832

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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)COC.Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4.ClH/c1-12(2)27-17-9-6-14(10-15(17)11-26-3)18(20(24)25)23-16-7-4-13(5-8-16)19(21)22;/h4-10,12,18,23H,11H2,1-3H3,(H3,21,22)(H,24,25);1H/p-1