methyl 5-[4-(5-carbamimidoylpyridin-3-yl)phenoxy]pentanoate hydrochloride

Systemtic Name: methyl 5-[4-(5-carbamimidoylpyridin-3-yl)phenoxy]pentanoate hydrochloride Openeye Name: methyl 5-[4-(5-carbamimidoyl-3-pyridyl)phenoxy]pentanoate hydrochloride CAS Name: 5-[4-(5-carbamimidoyl-3-pyridinyl)phenoxy]pentanoic acid methyl ester hydrochloride IUPAC Name: methyl 5-[4-(5-carbamimidoylpyridin-3-yl)phenoxy]pentanoate hydrochloride Traditional Name: 5-[4-(5-amidino-3-pyridyl)phenoxy]valeric acid methyl ester hydrochloride Formula: C18H22ClN3O3 MolecularWeight: 363.83858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCOC1=CC=C(C=C1)C2=CC(=CN=C2)C(=N)N.Cl

Isomeric SMILES

COC(=O)CCCCOC1=CC=C(C=C1)C2=CC(=CN=C2)C(=N)N.Cl

InChI

InChI=1S/C18H21N3O3.ClH/c1-23-17(22)4-2-3-9-24-16-7-5-13(6-8-16)14-10-15(18(19)20)12-21-11-14;/h5-8,10-12H,2-4,9H2,1H3,(H3,19,20);1H