3-[2,5-bis(oxidanylidene)-1-prop-1-en-2-yl-pyrrol-1-ium-1-yl]-4-phenyl-benzenecarbonitrile

Systemtic Name: 3-[2,5-bis(oxidanylidene)-1-prop-1-en-2-yl-pyrrol-1-ium-1-yl]-4-phenyl-benzenecarbonitrile Openeye Name: 3-(1-isopropenyl-2,5-dioxo-pyrrol-1-ium-1-yl)-4-phenyl-benzonitrile CAS Name: 3-[1-(1-methylethenyl)-2,5-dioxo-1-pyrrol-1-iumyl]-4-phenylbenzonitrile IUPAC Name: 3-(2,5-dioxo-1-prop-1-en-2-ylpyrrol-1-ium-1-yl)-4-phenylbenzonitrile Traditional Name: 3-(1-isopropenyl-2,5-diketo-3-pyrrolin-1-ium-1-yl)-4-phenyl-benzonitrile Formula: C20H15N2O2+ MolecularWeight: 315.3453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)[N+]1(C(=O)C=CC1=O)C2=C(C=CC(=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

CC(=C)[N+]1(C(=O)C=CC1=O)C2=C(C=CC(=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C20H15N2O2/c1-14(2)22(19(23)10-11-20(22)24)18-12-15(13-21)8-9-17(18)16-6-4-3-5-7-16/h3-12H,1H2,2H3/q+1