2-[5-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]-2-methoxy-phenyl]ethanoic acid

Systemtic Name: 2-[5-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]-2-methoxy-phenyl]ethanoic acid Openeye Name: 2-[5-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]-2-methoxy-phenyl]acetic acid CAS Name: 2-[5-[(E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoprop-2-enyl]-2-methoxyphenyl]acetic acid IUPAC Name: 2-[5-[(E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)prop-2-enoyl]-2-methoxyphenyl]acetic acid Traditional Name: 2-[5-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acryloyl]-2-methoxy-phenyl]acetic acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)C3=CC(=C(C=C3)OC)CC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)C3=CC(=C(C=C3)OC)CC(=O)O

InChI

InChI=1S/C23H22N2O4/c1-15-20(16(2)25(24-15)19-7-5-4-6-8-19)10-11-21(26)17-9-12-22(29-3)18(13-17)14-23(27)28/h4-13H,14H2,1-3H3,(H,27,28)/b11-10+