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8-(1-phenylpentan-2-yl)-1,3-dipropyl-7H-purine-2,6-dione

8-(1-phenylpentan-2-yl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name:8-(1-phenylpentan-2-yl)-1,3-dipropyl-7H-purine-2,6-dione
Openeye Name:8-(1-benzylbutyl)-1,3-dipropyl-7H-purine-2,6-dione
CAS Name:8-(1-phenylpentan-2-yl)-1,3-dipropyl-7H-purine-2,6-dione
IUPAC Name:8-(1-phenylpentan-2-yl)-1,3-dipropyl-7H-purine-2,6-dione
Traditional Name:8-(1-benzylbutyl)-1,3-dipropyl-7H-purine-2,6-quinone
Formula: C22H30N4O2
MolecularWeight: 382.4992
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3CCC)CCC


Isomeric SMILES

CCCC(CC1=CC=CC=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3CCC)CCC


InChI

InChI=1S/C22H30N4O2/c1-4-10-17(15-16-11-8-7-9-12-16)19-23-18-20(24-19)25(13-5-2)22(28)26(14-6-3)21(18)27/h7-9,11-12,17H,4-6,10,13-15H2,1-3H3,(H,23,24)


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