2-[4-naphthalen-1-yl-3,5-bis(oxidanylidene)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-naphthalen-1-yl-3,5-bis(oxidanylidene)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(1-naphthyl)-3,5-dioxo-piperazin-1-yl]acetonitrile CAS Name: 2-[4-(1-naphthalenyl)-3,5-dioxo-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-naphthalen-1-yl-3,5-dioxopiperazin-1-yl)acetonitrile Traditional Name: 2-[3,5-diketo-4-(1-naphthyl)piperazino]acetonitrile Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)CN1CC#N)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1C(=O)N(C(=O)CN1CC#N)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C16H13N3O2/c17-8-9-18-10-15(20)19(16(21)11-18)14-7-3-5-12-4-1-2-6-13(12)14/h1-7H,9-11H2