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

Systemtic Name: methyl (E)-3-[2-cyclohexyl-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-5-yl]prop-2-enoate Openeye Name: methyl (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-propenoic acid methyl ester IUPAC Name: methyl (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]acrylic acid methyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC(=C2C=CC(=O)C=C2)N(N1)C3CCCCC3

Isomeric SMILES

COC(=O)/C=C/C1=CC(=C2C=CC(=O)C=C2)N(N1)C3CCCCC3

InChI

InChI=1S/C19H22N2O3/c1-24-19(23)12-9-15-13-18(14-7-10-17(22)11-8-14)21(20-15)16-5-3-2-4-6-16/h7-13,16,20H,2-6H2,1H3/b12-9+