7-hexadecyl-8-[2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methyl-purine-2,6-dione

Systemtic Name: 7-hexadecyl-8-[2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methyl-purine-2,6-dione Openeye Name: 7-hexadecyl-8-[2-[1-(4-methoxyphenyl)ethylidene]hydrazino]-3-methyl-purine-2,6-dione CAS Name: 7-hexadecyl-8-[2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione IUPAC Name: 7-hexadecyl-8-[2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione Traditional Name: 7-cetyl-8-[N'-[1-(4-methoxyphenyl)ethylidene]hydrazino]-3-methyl-xanthine Formula: C31H48N6O3 MolecularWeight: 552.75122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(N=C1NN=C(C)C3=CC=C(C=C3)OC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(N=C1NN=C(C)C3=CC=C(C=C3)OC)N(C(=O)NC2=O)C

InChI

InChI=1S/C31H48N6O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-37-27-28(36(3)31(39)33-29(27)38)32-30(37)35-34-24(2)25-19-21-26(40-4)22-20-25/h19-22H,5-18,23H2,1-4H3,(H,32,35)(H,33,38,39)