2-(4-cyclopentyloxyphenyl)-5-(3-methylbutyl)-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-(4-cyclopentyloxyphenyl)-5-(3-methylbutyl)-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[4-(cyclopentoxy)phenyl]-4-hydroxy-5-isopentyl-1H-pyrimidin-6-one CAS Name: 2-(4-cyclopentyloxyphenyl)-4-hydroxy-5-(3-methylbutyl)-1H-pyrimidin-6-one IUPAC Name: 2-(4-cyclopentyloxyphenyl)-4-hydroxy-5-(3-methylbutyl)-1H-pyrimidin-6-one Traditional Name: 2-[4-(cyclopentoxy)phenyl]-4-hydroxy-5-isoamyl-1H-pyrimidin-6-one Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(N=C(NC1=O)C2=CC=C(C=C2)OC3CCCC3)O

Isomeric SMILES

CC(C)CCC1=C(N=C(NC1=O)C2=CC=C(C=C2)OC3CCCC3)O

InChI

InChI=1S/C20H26N2O3/c1-13(2)7-12-17-19(23)21-18(22-20(17)24)14-8-10-16(11-9-14)25-15-5-3-4-6-15/h8-11,13,15H,3-7,12H2,1-2H3,(H2,21,22,23,24)