benzene; [cyano(furan-2-yl)methyl] ethanoate

Systemtic Name: benzene; [cyano(furan-2-yl)methyl] ethanoate Openeye Name: benzene; [cyano(2-furyl)methyl] acetate CAS Name: acetic acid [cyano(2-furanyl)methyl] ester; benzene IUPAC Name: benzene; [cyano(furan-2-yl)methyl] acetate Traditional Name: acetic acid [cyano(2-furyl)methyl] ester; benzene Formula: C14H13NO3 MolecularWeight: 243.25792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C#N)C1=CC=CO1.C1=CC=CC=C1

Isomeric SMILES

CC(=O)OC(C#N)C1=CC=CO1.C1=CC=CC=C1

InChI

InChI=1S/C8H7NO3.C6H6/c1-6(10)12-8(5-9)7-3-2-4-11-7;1-2-4-6-5-3-1/h2-4,8H,1H3;1-6H