(7-nonyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-2-yl) hexanoate

Systemtic Name: (7-nonyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-2-yl) hexanoate Openeye Name: (7-nonyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-2-yl) hexanoate CAS Name: hexanoic acid (7-nonyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-2-yl) ester IUPAC Name: (7-nonyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-2-yl) hexanoate Traditional Name: hexanoic acid (7-nonyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-2-yl) ester Formula: C29H52O2 MolecularWeight: 432.72198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC2C(C1)CCC3C2CCC(C3)OC(=O)CCCCC

Isomeric SMILES

CCCCCCCCCC1CCC2C(C1)CCC3C2CCC(C3)OC(=O)CCCCC

InChI

InChI=1S/C29H52O2/c1-3-5-7-8-9-10-12-13-23-15-19-27-24(21-23)16-17-25-22-26(18-20-28(25)27)31-29(30)14-11-6-4-2/h23-28H,3-22H2,1-2H3