methyl 6-[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]hexanoate

Systemtic Name: methyl 6-[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]hexanoate Openeye Name: methyl 6-[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]hexanoate CAS Name: 6-[4-(5-carbamimidoyl-2-pyrazinyl)phenoxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]hexanoate Traditional Name: 6-[4-(5-amidinopyrazin-2-yl)phenoxy]hexanoic acid methyl ester Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=N)N

Isomeric SMILES

COC(=O)CCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=N)N

InChI

InChI=1S/C18H22N4O3/c1-24-17(23)5-3-2-4-10-25-14-8-6-13(7-9-14)15-11-22-16(12-21-15)18(19)20/h6-9,11-12H,2-5,10H2,1H3,(H3,19,20)