1,3,7-trimethyl-8-[(2E)-2-[(4-prop-2-enoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-[(2E)-2-[(4-prop-2-enoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-allyloxyphenyl)methylene]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-[(2E)-2-[(4-prop-2-enoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-[(2E)-2-[(4-prop-2-enoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-allyloxybenzylidene)hydrazino]-1,3,7-trimethyl-xanthine Formula: C18H20N6O3 MolecularWeight: 368.3898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NN=CC3=CC=C(C=C3)OCC=C)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1N/N=C/C3=CC=C(C=C3)OCC=C)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C18H20N6O3/c1-5-10-27-13-8-6-12(7-9-13)11-19-21-17-20-15-14(22(17)2)16(25)24(4)18(26)23(15)3/h5-9,11H,1,10H2,2-4H3,(H,20,21)/b19-11+