7-hexadecyl-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione

Systemtic Name: 7-hexadecyl-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione Openeye Name: 7-hexadecyl-1,3-dimethyl-8-(morpholinomethyl)purine-2,6-dione CAS Name: 7-hexadecyl-1,3-dimethyl-8-(4-morpholinylmethyl)purine-2,6-dione IUPAC Name: 7-hexadecyl-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione Traditional Name: 7-cetyl-1,3-dimethyl-8-(morpholinomethyl)xanthine Formula: C28H49N5O3 MolecularWeight: 503.72036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCOCC3

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCOCC3

InChI

InChI=1S/C28H49N5O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-33-24(23-32-19-21-36-22-20-32)29-26-25(33)27(34)31(3)28(35)30(26)2/h4-23H2,1-3H3