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1-[11-(hexadecylamino)undecyl]-3,7-dimethyl-purine-2,6-dione

1-[11-(hexadecylamino)undecyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name:1-[11-(hexadecylamino)undecyl]-3,7-dimethyl-purine-2,6-dione
Openeye Name:1-[11-(hexadecylamino)undecyl]-3,7-dimethyl-purine-2,6-dione
CAS Name:1-[11-(hexadecylamino)undecyl]-3,7-dimethylpurine-2,6-dione
IUPAC Name:1-[11-(hexadecylamino)undecyl]-3,7-dimethylpurine-2,6-dione
Traditional Name:1-[11-(cetylamino)undecyl]-3,7-dimethyl-xanthine
Formula: C34H63N5O2
MolecularWeight: 573.89632
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCCCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C


Isomeric SMILES

CCCCCCCCCCCCCCCCNCCCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C


InChI

InChI=1S/C34H63N5O2/c1-4-5-6-7-8-9-10-11-12-13-15-18-21-24-27-35-28-25-22-19-16-14-17-20-23-26-29-39-33(40)31-32(36-30-37(31)2)38(3)34(39)41/h30,35H,4-29H2,1-3H3


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