5-[2,4-bis(oxidanylidene)-3,1-benzoxazin-1-yl]pentanenitrile

Systemtic Name: 5-[2,4-bis(oxidanylidene)-3,1-benzoxazin-1-yl]pentanenitrile Openeye Name: 5-(2,4-dioxo-3,1-benzoxazin-1-yl)pentanenitrile CAS Name: 5-(2,4-dioxo-3,1-benzoxazin-1-yl)pentanenitrile IUPAC Name: 5-(2,4-dioxo-3,1-benzoxazin-1-yl)pentanenitrile Traditional Name: 5-(2,4-diketo-3,1-benzoxazin-1-yl)valeronitrile Formula: C13H12N2O3 MolecularWeight: 244.24598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC(=O)N2CCCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC(=O)N2CCCCC#N

InChI

InChI=1S/C13H12N2O3/c14-8-4-1-5-9-15-11-7-3-2-6-10(11)12(16)18-13(15)17/h2-3,6-7H,1,4-5,9H2