[4-(7H-purin-8-yl)cyclohexa-1,3-dien-1-yl] carbamate

Systemtic Name: [4-(7H-purin-8-yl)cyclohexa-1,3-dien-1-yl] carbamate Openeye Name: [4-(7H-purin-8-yl)cyclohexa-1,3-dien-1-yl] carbamate CAS Name: carbamic acid [4-(7H-purin-8-yl)-1-cyclohexa-1,3-dienyl] ester IUPAC Name: [4-(7H-purin-8-yl)cyclohexa-1,3-dien-1-yl] carbamate Traditional Name: carbamic acid [4-(7H-purin-8-yl)cyclohexa-1,3-dien-1-yl] ester Formula: C12H11N5O2 MolecularWeight: 257.24804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1C2=NC3=NC=NC=C3N2)OC(=O)N

Isomeric SMILES

C1CC(=CC=C1C2=NC3=NC=NC=C3N2)OC(=O)N

InChI

InChI=1S/C12H11N5O2/c13-12(18)19-8-3-1-7(2-4-8)10-16-9-5-14-6-15-11(9)17-10/h1,3,5-6H,2,4H2,(H2,13,18)(H,14,15,16,17)