2-[4-[(3-chloranyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-oxidanylidene-1H-pyrazol-2-yl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[(3-chloranyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-oxidanylidene-1H-pyrazol-2-yl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[4-[(3-chloro-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-[(3-chloro-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-[(3-chloro-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-oxo-1H-pyrazol-2-yl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[4-[(3-chloro-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-keto-3-methyl-3-pyrazolin-1-yl]-6-methyl-1H-pyrimidin-4-one Formula: C17H15ClN4O4 MolecularWeight: 374.7784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=O)C(=C(N2)C)C=C3C=C(C(=O)C(=C3)Cl)OC

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=O)C(=C(N2)C)C=C3C=C(C(=O)C(=C3)Cl)OC

InChI

InChI=1S/C17H15ClN4O4/c1-8-4-14(23)20-17(19-8)22-16(25)11(9(2)21-22)5-10-6-12(18)15(24)13(7-10)26-3/h4-7,21H,1-3H3,(H,19,20,23)