(E)-3-[2-cyclohexyl-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-5-yl]prop-2-enoate

Systemtic Name: (E)-3-[2-cyclohexyl-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-5-yl]prop-2-enoate Openeye Name: (E)-3-[2-cyclohexyl-3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-5-yl]prop-2-enoate CAS Name: (E)-3-[2-cyclohexyl-3-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyrazol-5-yl]-2-propenoate IUPAC Name: (E)-3-[2-cyclohexyl-3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-5-yl]prop-2-enoate Traditional Name: (E)-3-[1-cyclohexyl-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-pyrazolin-3-yl]acrylate Formula: C18H19N2O3- MolecularWeight: 311.35506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=C3C=CC(=O)C=C3)C=C(N2)C=CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=C3C=CC(=O)C=C3)C=C(N2)/C=C/C(=O)[O-]

InChI

InChI=1S/C18H20N2O3/c21-16-9-6-13(7-10-16)17-12-14(8-11-18(22)23)19-20(17)15-4-2-1-3-5-15/h6-12,15,19H,1-5H2,(H,22,23)/p-1/b11-8+