(E)-4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-(phenylmethyl)amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-(phenylmethyl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[benzyl-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-(phenylmethyl)amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[benzyl-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[benzyl-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]amino]-4-keto-but-2-enoate Formula: C28H24N3O4- MolecularWeight: 466.50786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2CN(CC3=CC=CC=C3)C(=O)C=CC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2CN(CC3=CC=CC=C3)C(=O)/C=C/C(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C28H25N3O4/c1-35-25-14-12-22(13-15-25)28-23(20-31(29-28)24-10-6-3-7-11-24)19-30(26(32)16-17-27(33)34)18-21-8-4-2-5-9-21/h2-17,20H,18-19H2,1H3,(H,33,34)/p-1/b17-16+