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

Systemtic Name: 8-[(2E)-2-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]hydrazinyl]-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-allyloxy-3-methoxy-phenyl)methylene]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-allyloxy-3-methoxy-benzylidene)hydrazino]-1,3,7-trimethyl-xanthine Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N6O4/c1-6-9-29-13-8-7-12(10-14(13)28-5)11-20-22-18-21-16-15(23(18)2)17(26)25(4)19(27)24(16)3/h6-8,10-11H,1,9H2,2-5H3,(H,21,22)/b20-11+