4-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile

Systemtic Name: 4-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile Openeye Name: 4-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl]-3-hydroxy-2-oxo-indolin-1-yl]butanenitrile CAS Name: 4-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-3-hydroxy-2-oxo-1-indolyl]butanenitrile IUPAC Name: 4-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-3-hydroxy-2-oxoindol-1-yl]butanenitrile Traditional Name: 4-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl]-3-hydroxy-2-keto-indolin-1-yl]butyronitrile Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)CC3(C4=CC=CC=C4N(C3=O)CCCC#N)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)CC3(C4=CC=CC=C4N(C3=O)CCCC#N)O

InChI

InChI=1S/C22H20N2O5/c23-9-3-4-10-24-17-6-2-1-5-16(17)22(27,21(24)26)14-18(25)15-7-8-19-20(13-15)29-12-11-28-19/h1-2,5-8,13,27H,3-4,10-12,14H2