2-[(3E)-3-(6-oxidanylidene-4-phenyl-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]propanoic acid

Systemtic Name: 2-[(3E)-3-(6-oxidanylidene-4-phenyl-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]propanoic acid Openeye Name: 2-[(3E)-3-(6-oxo-4-phenyl-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]propanoic acid CAS Name: 2-[(3E)-3-(6-oxo-4-phenyl-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazol-4-yl]propanoic acid IUPAC Name: 2-[(3E)-3-(6-oxo-4-phenylcyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]propanoic acid Traditional Name: 2-[(3E)-3-(6-keto-4-phenyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazolin-4-yl]propionic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNNC1=C2C=CC(=CC2=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C\1=CNN/C1=C/2\C=CC(=CC2=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H16N2O3/c1-11(18(22)23)15-10-19-20-17(15)14-8-7-13(9-16(14)21)12-5-3-2-4-6-12/h2-11,19-20H,1H3,(H,22,23)/b17-14+