[(4-carbamimidoylphenyl)amino] 2-[5-ethenyl-3-ethyl-2-(2-hydroxyethyloxy)phenyl]ethanoate hydrochloride

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[5-ethenyl-3-ethyl-2-(2-hydroxyethyloxy)phenyl]ethanoate hydrochloride Openeye Name: (4-carbamimidoylanilino) 2-[3-ethyl-2-(2-hydroxyethoxy)-5-vinyl-phenyl]acetate hydrochloride CAS Name: 2-[5-ethenyl-3-ethyl-2-(2-hydroxyethoxy)phenyl]acetic acid (4-carbamimidoylanilino) ester hydrochloride IUPAC Name: (4-carbamimidoylanilino) 2-[5-ethenyl-3-ethyl-2-(2-hydroxyethoxy)phenyl]acetate hydrochloride Traditional Name: 2-[3-ethyl-2-(2-hydroxyethoxy)-5-vinyl-phenyl]acetic acid (4-amidinoanilino) ester hydrochloride Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1OCCO)CC(=O)ONC2=CC=C(C=C2)C(=N)N)C=C.Cl

Isomeric SMILES

CCC1=CC(=CC(=C1OCCO)CC(=O)ONC2=CC=C(C=C2)C(=N)N)C=C.Cl

InChI

InChI=1S/C21H25N3O4.ClH/c1-3-14-11-15(4-2)20(27-10-9-25)17(12-14)13-19(26)28-24-18-7-5-16(6-8-18)21(22)23;/h3,5-8,11-12,24-25H,1,4,9-10,13H2,2H3,(H3,22,23);1H