5-(3-cyclopropylpropyl)-2-hept-2-ynoxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 5-(3-cyclopropylpropyl)-2-hept-2-ynoxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione Openeye Name: 5-(3-cyclopropylpropyl)-2-hept-2-ynoxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione CAS Name: 5-(3-cyclopropylpropyl)-2-hept-2-ynoxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione IUPAC Name: 5-(3-cyclopropylpropyl)-2-hept-2-ynoxy-3H-pyrano[2,3-d]pyrimidine-4,7-dione Traditional Name: 5-(3-cyclopropylpropyl)-2-hept-2-ynoxy-3H-pyrano[2,3-d]pyrimidine-4,7-quinone Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCOC1=NC2=C(C(=CC(=O)O2)CCCC3CC3)C(=O)N1

Isomeric SMILES

CCCCC#CCOC1=NC2=C(C(=CC(=O)O2)CCCC3CC3)C(=O)N1

InChI

InChI=1S/C20H24N2O4/c1-2-3-4-5-6-12-25-20-21-18(24)17-15(9-7-8-14-10-11-14)13-16(23)26-19(17)22-20/h13-14H,2-4,7-12H2,1H3,(H,21,22,24)