2-[3-(naphthalen-2-ylmethyl)-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanenitrile

Systemtic Name: 2-[3-(naphthalen-2-ylmethyl)-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanenitrile Openeye Name: 2-[3-(2-naphthylmethyl)-2,4-dioxo-pyrimidin-1-yl]acetonitrile CAS Name: 2-[3-(2-naphthalenylmethyl)-2,4-dioxo-1-pyrimidinyl]acetonitrile IUPAC Name: 2-[3-(naphthalen-2-ylmethyl)-2,4-dioxopyrimidin-1-yl]acetonitrile Traditional Name: 2-[2,4-diketo-3-(2-naphthylmethyl)pyrimidin-1-yl]acetonitrile Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CN3C(=O)C=CN(C3=O)CC#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CN3C(=O)C=CN(C3=O)CC#N

InChI

InChI=1S/C17H13N3O2/c18-8-10-19-9-7-16(21)20(17(19)22)12-13-5-6-14-3-1-2-4-15(14)11-13/h1-7,9,11H,10,12H2