(4E)-4-(6-chloranyl-7,9-dihydropurin-8-ylidene)-2-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(6-chloranyl-7,9-dihydropurin-8-ylidene)-2-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-(6-chloro-7,9-dihydropurin-8-ylidene)-2-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-(6-chloro-7,9-dihydropurin-8-ylidene)-2-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-(6-chloro-7,9-dihydropurin-8-ylidene)-2-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-(6-chloro-7,9-dihydropurin-8-ylidene)-2-hydroxy-cyclohexa-2,5-dien-1-one Formula: C11H7ClN4O2 MolecularWeight: 262.65188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC1=C2NC3=C(N2)N=CN=C3Cl)O

Isomeric SMILES

C\1=CC(=O)C(=C/C1=C/2\NC3=C(N2)N=CN=C3Cl)O

InChI

InChI=1S/C11H7ClN4O2/c12-9-8-11(14-4-13-9)16-10(15-8)5-1-2-6(17)7(18)3-5/h1-4,15,18H,(H,13,14,16)/b10-5+