4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-[1-(2-cyanoethyl)-3-indolyl]-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCC(=O)C2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCC(=O)C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C21H17N3O3/c1-26-21-11-15(12-23)7-8-20(21)27-14-19(25)17-13-24(10-4-9-22)18-6-3-2-5-16(17)18/h2-3,5-8,11,13H,4,10,14H2,1H3