6-cyclohex-2-en-1-yl-9-(phenylmethyl)purine

Systemtic Name: 6-cyclohex-2-en-1-yl-9-(phenylmethyl)purine Openeye Name: 9-benzyl-6-cyclohex-2-en-1-yl-purine CAS Name: 6-(1-cyclohex-2-enyl)-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-6-cyclohex-2-en-1-ylpurine Traditional Name: 9-benzyl-6-cyclohex-2-en-1-yl-purine Formula: C18H18N4 MolecularWeight: 290.36232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CC(C1)C2=C3C(=NC=N2)N(C=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CC=CC(C1)C2=C3C(=NC=N2)N(C=N3)CC4=CC=CC=C4

InChI

InChI=1S/C18H18N4/c1-3-7-14(8-4-1)11-22-13-21-17-16(19-12-20-18(17)22)15-9-5-2-6-10-15/h1,3-5,7-9,12-13,15H,2,6,10-11H2