(E)-3-[3-ethoxycarbonyl-1-(3-methylphenyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (E)-3-[3-ethoxycarbonyl-1-(3-methylphenyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (E)-3-[3-ethoxycarbonyl-1-(m-tolyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[3-ethoxycarbonyl-1-(3-methylphenyl)-4-pyrazolyl]-2-propenoate IUPAC Name: (E)-3-[3-ethoxycarbonyl-1-(3-methylphenyl)pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[3-carbethoxy-1-(m-tolyl)pyrazol-4-yl]acrylate Formula: C16H15N2O4- MolecularWeight: 299.3013

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1C=CC(=O)[O-])C2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1=NN(C=C1/C=C/C(=O)[O-])C2=CC=CC(=C2)C

InChI

InChI=1S/C16H16N2O4/c1-3-22-16(21)15-12(7-8-14(19)20)10-18(17-15)13-6-4-5-11(2)9-13/h4-10H,3H2,1-2H3,(H,19,20)/p-1/b8-7+