4-[5-methyl-2,3-bis(oxidanylidene)indol-1-yl]butanenitrile

Systemtic Name: 4-[5-methyl-2,3-bis(oxidanylidene)indol-1-yl]butanenitrile Openeye Name: 4-(5-methyl-2,3-dioxo-indolin-1-yl)butanenitrile CAS Name: 4-(5-methyl-2,3-dioxo-1-indolyl)butanenitrile IUPAC Name: 4-(5-methyl-2,3-dioxoindol-1-yl)butanenitrile Traditional Name: 4-(2,3-diketo-5-methyl-indolin-1-yl)butyronitrile Formula: C13H12N2O2 MolecularWeight: 228.24658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)CCCC#N

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)CCCC#N

InChI

InChI=1S/C13H12N2O2/c1-9-4-5-11-10(8-9)12(16)13(17)15(11)7-3-2-6-14/h4-5,8H,2-3,7H2,1H3