(1,3-diphenylpyrazol-4-yl)methyl (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C26H22N2O4/c1-31-24-16-19(12-14-23(24)29)13-15-25(30)32-18-21-17-28(22-10-6-3-7-11-22)27-26(21)20-8-4-2-5-9-20/h2-17,29H,18H2,1H3/b15-13+