8-(4,5,6,7-tetramethyl-1-oxidanyl-2,3-dihydro-1H-inden-2-yl)octanoate

Systemtic Name: 8-(4,5,6,7-tetramethyl-1-oxidanyl-2,3-dihydro-1H-inden-2-yl)octanoate Openeye Name: 8-(1-hydroxy-4,5,6,7-tetramethyl-indan-2-yl)octanoate CAS Name: 8-(1-hydroxy-4,5,6,7-tetramethyl-2,3-dihydro-1H-inden-2-yl)octanoate IUPAC Name: 8-(1-hydroxy-4,5,6,7-tetramethyl-2,3-dihydro-1H-inden-2-yl)octanoate Traditional Name: 8-(1-hydroxy-4,5,6,7-tetramethyl-indan-2-yl)caprylate Formula: C21H31O3- MolecularWeight: 331.46904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(C(C2)CCCCCCCC(=O)[O-])O)C(=C1C)C)C

Isomeric SMILES

CC1=C(C2=C(C(C(C2)CCCCCCCC(=O)[O-])O)C(=C1C)C)C

InChI

InChI=1S/C21H32O3/c1-13-14(2)16(4)20-18(15(13)3)12-17(21(20)24)10-8-6-5-7-9-11-19(22)23/h17,21,24H,5-12H2,1-4H3,(H,22,23)/p-1