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

Systemtic Name: 4-[(3S)-3-(furan-2-yl)-5-methyl-1,3-dihydropyrazol-2-yl]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[(3S)-3-(2-furyl)-5-methyl-1,3-dihydropyrazol-2-yl]-4-oxo-but-2-enoate CAS Name: 4-[(3S)-3-(2-furanyl)-5-methyl-1,3-dihydropyrazol-2-yl]-4-oxo-2-butenoate IUPAC Name: 4-[(3S)-3-(furan-2-yl)-5-methyl-1,3-dihydropyrazol-2-yl]-4-oxobut-2-enoate Traditional Name: 4-[(5S)-5-(2-furyl)-3-methyl-3-pyrazolin-1-yl]-4-keto-but-2-enoate Formula: C12H11N2O4- MolecularWeight: 247.22674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(N1)C(=O)C=CC(=O)[O-])C2=CC=CO2

Isomeric SMILES

CC1=C[C@H](N(N1)C(=O)C=CC(=O)[O-])C2=CC=CO2

InChI

InChI=1S/C12H12N2O4/c1-8-7-9(10-3-2-6-18-10)14(13-8)11(15)4-5-12(16)17/h2-7,9,13H,1H3,(H,16,17)/p-1/t9-/m0/s1