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

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[5-ethyl-2-(2-hydroxyethyloxy)-3-propyl-phenyl]ethanoate hydrochloride Openeye Name: (4-carbamimidoylanilino) 2-[5-ethyl-2-(2-hydroxyethoxy)-3-propyl-phenyl]acetate hydrochloride CAS Name: 2-[5-ethyl-2-(2-hydroxyethoxy)-3-propylphenyl]acetic acid (4-carbamimidoylanilino) ester hydrochloride IUPAC Name: (4-carbamimidoylanilino) 2-[5-ethyl-2-(2-hydroxyethoxy)-3-propylphenyl]acetate hydrochloride Traditional Name: 2-[5-ethyl-2-(2-hydroxyethoxy)-3-propyl-phenyl]acetic acid (4-amidinoanilino) ester hydrochloride Formula: C22H30ClN3O4 MolecularWeight: 435.9443

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1OCCO)CC(=O)ONC2=CC=C(C=C2)C(=N)N)CC.Cl

Isomeric SMILES

CCCC1=CC(=CC(=C1OCCO)CC(=O)ONC2=CC=C(C=C2)C(=N)N)CC.Cl

InChI

InChI=1S/C22H29N3O4.ClH/c1-3-5-17-12-15(4-2)13-18(21(17)28-11-10-26)14-20(27)29-25-19-8-6-16(7-9-19)22(23)24;/h6-9,12-13,25-26H,3-5,10-11,14H2,1-2H3,(H3,23,24);1H