2-[4-[[butyl-[6-(4-methylphenyl)pyrazin-2-yl]amino]methyl]-2-methyl-phenoxy]ethanoate

Systemtic Name: 2-[4-[[butyl-[6-(4-methylphenyl)pyrazin-2-yl]amino]methyl]-2-methyl-phenoxy]ethanoate Openeye Name: 2-[4-[[butyl-[6-(p-tolyl)pyrazin-2-yl]amino]methyl]-2-methyl-phenoxy]acetate CAS Name: 2-[4-[[butyl-[6-(4-methylphenyl)-2-pyrazinyl]amino]methyl]-2-methylphenoxy]acetate IUPAC Name: 2-[4-[[butyl-[6-(4-methylphenyl)pyrazin-2-yl]amino]methyl]-2-methylphenoxy]acetate Traditional Name: 2-[4-[[butyl-[6-(p-tolyl)pyrazin-2-yl]amino]methyl]-2-methyl-phenoxy]acetate Formula: C25H28N3O3- MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC(=C(C=C1)OCC(=O)[O-])C)C2=NC(=CN=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCN(CC1=CC(=C(C=C1)OCC(=O)[O-])C)C2=NC(=CN=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H29N3O3/c1-4-5-12-28(16-20-8-11-23(19(3)13-20)31-17-25(29)30)24-15-26-14-22(27-24)21-9-6-18(2)7-10-21/h6-11,13-15H,4-5,12,16-17H2,1-3H3,(H,29,30)/p-1