2-[4-[4-[4-(2-oxidanidyl-2-oxidanylidene-ethyl)phenyl]hexan-3-yl]phenyl]ethanoate

Systemtic Name: 2-[4-[4-[4-(2-oxidanidyl-2-oxidanylidene-ethyl)phenyl]hexan-3-yl]phenyl]ethanoate Openeye Name: 2-[4-[1-ethyl-2-[4-(2-oxido-2-oxo-ethyl)phenyl]butyl]phenyl]acetate CAS Name: 2-[4-[4-[4-(2-oxido-2-oxoethyl)phenyl]hexan-3-yl]phenyl]acetate IUPAC Name: 2-[4-[4-[4-(2-oxido-2-oxoethyl)phenyl]hexan-3-yl]phenyl]acetate Traditional Name: 2-[4-[1-ethyl-2-[4-(2-keto-2-oxido-ethyl)phenyl]butyl]phenyl]acetate Formula: C22H24O4-2 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)CC(=O)[O-])C(CC)C2=CC=C(C=C2)CC(=O)[O-]

Isomeric SMILES

CCC(C1=CC=C(C=C1)CC(=O)[O-])C(CC)C2=CC=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C22H26O4/c1-3-19(17-9-5-15(6-10-17)13-21(23)24)20(4-2)18-11-7-16(8-12-18)14-22(25)26/h5-12,19-20H,3-4,13-14H2,1-2H3,(H,23,24)(H,25,26)/p-2