4-[5-methyl-3-oxidanylidene-4-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-2-yl]benzoate

Systemtic Name: 4-[5-methyl-3-oxidanylidene-4-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-2-yl]benzoate Openeye Name: 4-[4-[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]benzoate CAS Name: 4-[4-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]benzoate IUPAC Name: 4-[4-[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]benzoate Traditional Name: 4-[4-[(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-5-keto-3-methyl-3-pyrazolin-1-yl]benzoate Formula: C18H13N2O5- MolecularWeight: 337.30622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)C(=O)[O-])C=C3C=CC(=O)C(=C3)O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)C(=O)[O-])C=C3C=CC(=O)C(=C3)O

InChI

InChI=1S/C18H14N2O5/c1-10-14(8-11-2-7-15(21)16(22)9-11)17(23)20(19-10)13-5-3-12(4-6-13)18(24)25/h2-9,19,22H,1H3,(H,24,25)/p-1