2-[4-[(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)acryloyl]-2-methoxy-phenoxy]acetic acid Formula: C20H23ClN2O5 MolecularWeight: 406.86002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)C2=CC(=C(C=C2)OCC(=O)O)OC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)C2=CC(=C(C=C2)OCC(=O)O)OC)Cl

InChI

InChI=1S/C20H23ClN2O5/c1-4-5-10-23-20(21)15(13(2)22-23)7-8-16(24)14-6-9-17(18(11-14)27-3)28-12-19(25)26/h6-9,11H,4-5,10,12H2,1-3H3,(H,25,26)/b8-7+