2-[4-(7-methoxynaphthalen-1-yl)-3,5-bis(oxidanylidene)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(7-methoxynaphthalen-1-yl)-3,5-bis(oxidanylidene)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(7-methoxy-1-naphthyl)-3,5-dioxo-piperazin-1-yl]acetonitrile CAS Name: 2-[4-(7-methoxy-1-naphthalenyl)-3,5-dioxo-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(7-methoxynaphthalen-1-yl)-3,5-dioxopiperazin-1-yl]acetonitrile Traditional Name: 2-[3,5-diketo-4-(7-methoxy-1-naphthyl)piperazino]acetonitrile Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CC=C2N3C(=O)CN(CC3=O)CC#N)C=C1

Isomeric SMILES

COC1=CC2=C(C=CC=C2N3C(=O)CN(CC3=O)CC#N)C=C1

InChI

InChI=1S/C17H15N3O3/c1-23-13-6-5-12-3-2-4-15(14(12)9-13)20-16(21)10-19(8-7-18)11-17(20)22/h2-6,9H,8,10-11H2,1H3