7-hexyl-8-[2-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-purine-2,6-dione

Systemtic Name: 7-hexyl-8-[2-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-purine-2,6-dione Openeye Name: 7-hexyl-8-[2-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-3-methyl-purine-2,6-dione CAS Name: 7-hexyl-8-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-3-methylpurine-2,6-dione IUPAC Name: 7-hexyl-8-[2-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-methylpurine-2,6-dione Traditional Name: 7-hexyl-8-[N'-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-3-methyl-xanthine Formula: C20H26N6O4 MolecularWeight: 414.45824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(N=C1NNC=C3C=CC=C(C3=O)OC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCN1C2=C(N=C1NNC=C3C=CC=C(C3=O)OC)N(C(=O)NC2=O)C

InChI

InChI=1S/C20H26N6O4/c1-4-5-6-7-11-26-15-17(25(2)20(29)23-18(15)28)22-19(26)24-21-12-13-9-8-10-14(30-3)16(13)27/h8-10,12,21H,4-7,11H2,1-3H3,(H,22,24)(H,23,28,29)