5-butyl-2-[3-(phenylmethoxymethyl)cyclobutyl]oxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 5-butyl-2-[3-(phenylmethoxymethyl)cyclobutyl]oxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione Openeye Name: 2-[3-(benzyloxymethyl)cyclobutoxy]-5-butyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione CAS Name: 5-butyl-2-[3-(phenylmethoxymethyl)cyclobutyl]oxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione IUPAC Name: 5-butyl-2-[3-(phenylmethoxymethyl)cyclobutyl]oxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione Traditional Name: 2-[3-(benzoxymethyl)cyclobutoxy]-5-butyl-3H-pyrano[2,3-d]pyrimidine-4,7-quinone Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=O)NC(=N2)OC3CC(C3)COCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=O)NC(=N2)OC3CC(C3)COCC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O5/c1-2-3-9-17-12-19(26)30-22-20(17)21(27)24-23(25-22)29-18-10-16(11-18)14-28-13-15-7-5-4-6-8-15/h4-8,12,16,18H,2-3,9-11,13-14H2,1H3,(H,24,25,27)