4-(6-chloranyl-9-phenethyl-7H-purin-8-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(6-chloranyl-9-phenethyl-7H-purin-8-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(6-chloro-9-phenethyl-7H-purin-8-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(6-chloro-9-phenethyl-7H-purin-8-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(6-chloro-9-phenethyl-7H-purin-8-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(6-chloro-9-phenethyl-7H-purin-8-ylidene)cyclohexa-2,5-dien-1-one Formula: C19H15ClN4O MolecularWeight: 350.8016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C3C=CC(=O)C=C3)NC4=C2N=CN=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C3C=CC(=O)C=C3)NC4=C2N=CN=C4Cl

InChI

InChI=1S/C19H15ClN4O/c20-17-16-19(22-12-21-17)24(11-10-13-4-2-1-3-5-13)18(23-16)14-6-8-15(25)9-7-14/h1-9,12,23H,10-11H2