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

Systemtic Name: 1,3,7-trimethyl-8-[(2E)-2-[(2-propoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione Openeye Name: 1,3,7-trimethyl-8-[(2E)-2-[(2-propoxyphenyl)methylene]hydrazino]purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-[(2E)-2-[(2-propoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-[(2E)-2-[(2-propoxyphenyl)methylidene]hydrazinyl]purine-2,6-dione Traditional Name: 1,3,7-trimethyl-8-[(N'E)-N'-(2-propoxybenzylidene)hydrazino]xanthine Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=NNC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCCOC1=CC=CC=C1/C=N/NC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C18H22N6O3/c1-5-10-27-13-9-7-6-8-12(13)11-19-21-17-20-15-14(22(17)2)16(25)24(4)18(26)23(15)3/h6-9,11H,5,10H2,1-4H3,(H,20,21)/b19-11+