2-chloranyl-6-(1-ethoxyethenyl)-9-(phenylmethyl)purine

Systemtic Name: 2-chloranyl-6-(1-ethoxyethenyl)-9-(phenylmethyl)purine Openeye Name: 9-benzyl-2-chloro-6-(1-ethoxyvinyl)purine CAS Name: 2-chloro-6-(1-ethoxyethenyl)-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-2-chloro-6-(1-ethoxyethenyl)purine Traditional Name: 9-benzyl-2-chloro-6-(1-ethoxyvinyl)purine Formula: C16H15ClN4O MolecularWeight: 314.7695

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C)C1=C2C(=NC(=N1)Cl)N(C=N2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=C)C1=C2C(=NC(=N1)Cl)N(C=N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H15ClN4O/c1-3-22-11(2)13-14-15(20-16(17)19-13)21(10-18-14)9-12-7-5-4-6-8-12/h4-8,10H,2-3,9H2,1H3