6-[2,4-bis(oxidanylidene)pyrimidin-1-yl]hexyl benzoate

Systemtic Name: 6-[2,4-bis(oxidanylidene)pyrimidin-1-yl]hexyl benzoate Openeye Name: 6-(2,4-dioxopyrimidin-1-yl)hexyl benzoate CAS Name: benzoic acid 6-(2,4-dioxo-1-pyrimidinyl)hexyl ester IUPAC Name: 6-(2,4-dioxopyrimidin-1-yl)hexyl benzoate Traditional Name: benzoic acid 6-(2,4-diketopyrimidin-1-yl)hexyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCCCCCN2C=CC(=O)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCCCCCN2C=CC(=O)NC2=O

InChI

InChI=1S/C17H20N2O4/c20-15-10-12-19(17(22)18-15)11-6-1-2-7-13-23-16(21)14-8-4-3-5-9-14/h3-5,8-10,12H,1-2,6-7,11,13H2,(H,18,20,22)