[(2E)-2-(7H-purin-8-ylmethylidene)cyclopropyl]methyl ethanoate

Systemtic Name: [(2E)-2-(7H-purin-8-ylmethylidene)cyclopropyl]methyl ethanoate Openeye Name: [(2E)-2-(7H-purin-8-ylmethylene)cyclopropyl]methyl acetate CAS Name: acetic acid [(2E)-2-(7H-purin-8-ylmethylidene)cyclopropyl]methyl ester IUPAC Name: [(2E)-2-(7H-purin-8-ylmethylidene)cyclopropyl]methyl acetate Traditional Name: acetic acid [(2E)-2-(7H-purin-8-ylmethylene)cyclopropyl]methyl ester Formula: C12H12N4O2 MolecularWeight: 244.24928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC1=CC2=NC3=NC=NC=C3N2

Isomeric SMILES

CC(=O)OCC\1C/C1=C\C2=NC3=NC=NC=C3N2

InChI

InChI=1S/C12H12N4O2/c1-7(17)18-5-9-2-8(9)3-11-15-10-4-13-6-14-12(10)16-11/h3-4,6,9H,2,5H2,1H3,(H,13,14,15,16)/b8-3+