[3-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]phenyl] benzoate

Systemtic Name: [3-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]phenyl] benzoate Openeye Name: [3-[(2,4-dioxopyrimidin-1-yl)methyl]phenyl] benzoate CAS Name: benzoic acid [3-[(2,4-dioxo-1-pyrimidinyl)methyl]phenyl] ester IUPAC Name: [3-[(2,4-dioxopyrimidin-1-yl)methyl]phenyl] benzoate Traditional Name: benzoic acid [3-[(2,4-diketopyrimidin-1-yl)methyl]phenyl] ester Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)CN3C=CC(=O)NC3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)CN3C=CC(=O)NC3=O

InChI

InChI=1S/C18H14N2O4/c21-16-9-10-20(18(23)19-16)12-13-5-4-8-15(11-13)24-17(22)14-6-2-1-3-7-14/h1-11H,12H2,(H,19,21,23)