2-(1-methylindol-2-yl)-3-oxidanylidene-4-(4-propylphenoxy)butanenitrile

Systemtic Name: 2-(1-methylindol-2-yl)-3-oxidanylidene-4-(4-propylphenoxy)butanenitrile Openeye Name: 2-(1-methylindol-2-yl)-3-oxo-4-(4-propylphenoxy)butanenitrile CAS Name: 2-(1-methyl-2-indolyl)-3-oxo-4-(4-propylphenoxy)butanenitrile IUPAC Name: 2-(1-methylindol-2-yl)-3-oxo-4-(4-propylphenoxy)butanenitrile Traditional Name: 3-keto-2-(1-methylindol-2-yl)-4-(4-propylphenoxy)butyronitrile Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C

InChI

InChI=1S/C22H22N2O2/c1-3-6-16-9-11-18(12-10-16)26-15-22(25)19(14-23)21-13-17-7-4-5-8-20(17)24(21)2/h4-5,7-13,19H,3,6,15H2,1-2H3