[1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate

Systemtic Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate Openeye Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (2-indan-5-yl-2-keto-1-methyl-ethyl) ester Formula: C20H17NO3 MolecularWeight: 319.35388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H17NO3/c1-13(24-20(23)16-7-5-14(12-21)6-8-16)19(22)18-10-9-15-3-2-4-17(15)11-18/h5-11,13H,2-4H2,1H3