cyanomethyl 2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]ethanoate

Systemtic Name: cyanomethyl 2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]ethanoate Openeye Name: cyanomethyl 2-(3-benzyl-2,6-dioxo-pyrimidin-1-yl)acetate CAS Name: 2-[2,6-dioxo-3-(phenylmethyl)-1-pyrimidinyl]acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(3-benzyl-2,6-dioxopyrimidin-1-yl)acetate Traditional Name: 2-(3-benzyl-2,6-diketo-pyrimidin-1-yl)acetic acid cyanomethyl ester Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC(=O)N(C2=O)CC(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC(=O)N(C2=O)CC(=O)OCC#N

InChI

InChI=1S/C15H13N3O4/c16-7-9-22-14(20)11-18-13(19)6-8-17(15(18)21)10-12-4-2-1-3-5-12/h1-6,8H,9-11H2