8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-3-methyl-7-octyl-purine-2,6-dione

Systemtic Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-3-methyl-7-octyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylene]hydrazino]-3-methyl-7-octyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-3-methyl-7-octylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-3-methyl-7-octylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-ethoxybenzylidene)hydrazino]-3-methyl-7-octyl-xanthine Formula: C23H32N6O3 MolecularWeight: 440.53858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)OCC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCN1C2=C(N=C1N/N=C/C3=CC=C(C=C3)OCC)N(C(=O)NC2=O)C

InChI

InChI=1S/C23H32N6O3/c1-4-6-7-8-9-10-15-29-19-20(28(3)23(31)26-21(19)30)25-22(29)27-24-16-17-11-13-18(14-12-17)32-5-2/h11-14,16H,4-10,15H2,1-3H3,(H,25,27)(H,26,30,31)/b24-16+