4-[(3S)-3-(furan-2-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[(3S)-3-(furan-2-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[(3S)-3-(2-furyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-4-oxo-but-2-enoate CAS Name: 4-[(3S)-3-(2-furanyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-4-oxo-2-butenoate IUPAC Name: 4-[(3S)-3-(furan-2-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-4-oxobut-2-enoate Traditional Name: 4-[(5S)-5-(2-furyl)-3-(4-methoxyphenyl)-3-pyrazolin-1-yl]-4-keto-but-2-enoate Formula: C18H15N2O5- MolecularWeight: 339.3221

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(N(N2)C(=O)C=CC(=O)[O-])C3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)C2=C[C@H](N(N2)C(=O)C=CC(=O)[O-])C3=CC=CO3

InChI

InChI=1S/C18H16N2O5/c1-24-13-6-4-12(5-7-13)14-11-15(16-3-2-10-25-16)20(19-14)17(21)8-9-18(22)23/h2-11,15,19H,1H3,(H,22,23)/p-1/t15-/m0/s1