(4E,5Z)-4-(1,7-dihydropurin-6-ylidene)-5-(4-oxidanyl-6-oxidanylidene-3-propan-2-yl-cyclohexa-2,4-dien-1-ylidene)pyrazolidin-3-one

Systemtic Name: (4E,5Z)-4-(1,7-dihydropurin-6-ylidene)-5-(4-oxidanyl-6-oxidanylidene-3-propan-2-yl-cyclohexa-2,4-dien-1-ylidene)pyrazolidin-3-one Openeye Name: (4E,5Z)-4-(1,7-dihydropurin-6-ylidene)-5-(4-hydroxy-3-isopropyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)pyrazolidin-3-one CAS Name: (4E,5Z)-4-(1,7-dihydropurin-6-ylidene)-5-(4-hydroxy-6-oxo-3-propan-2-yl-1-cyclohexa-2,4-dienylidene)-3-pyrazolidinone IUPAC Name: (4E,5Z)-4-(1,7-dihydropurin-6-ylidene)-5-(4-hydroxy-6-oxo-3-propan-2-ylcyclohexa-2,4-dien-1-ylidene)pyrazolidin-3-one Traditional Name: (4E,5Z)-4-(1,7-dihydropurin-6-ylidene)-5-(4-hydroxy-3-isopropyl-6-keto-cyclohexa-2,4-dien-1-ylidene)pyrazolidin-3-one Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C3C4=C(N=CN3)N=CN4)C(=O)NN2)C(=O)C=C1O

Isomeric SMILES

CC(C)C1=C/C(=C/2\C(=C/3\C4=C(N=CN3)N=CN4)\C(=O)NN2)/C(=O)C=C1O

InChI

InChI=1S/C17H16N6O3/c1-7(2)8-3-9(11(25)4-10(8)24)13-12(17(26)23-22-13)14-15-16(20-5-18-14)21-6-19-15/h3-7,22,24H,1-2H3,(H,18,20)(H,19,21)(H,23,26)/b13-9-,14-12+