(5S,6S,11R,17E)-17-(phenylmethylidene)-4,7,12-trioxatrispiro[4.0.4^{6}.0.4^{11}.3^{5}]octadecan-16-one

Systemtic Name: (5S,6S,11R,17E)-17-(phenylmethylidene)-4,7,12-trioxatrispiro[4.0.4^{6}.0.4^{11}.3^{5}]octadecan-16-one Openeye Name: (5S,6S,11R,17E)-17-benzylidene-4,7,12-trioxatrispiro[4.0.4^{6}.0.4^{11}.3^{5}]octadecan-16-one CAS Name: (5S,6S,11R,17E)-17-(phenylmethylene)-4,7,12-trioxatrispiro[4.0.4^{6}.0.4^{11}.3^{5}]octadecan-16-one IUPAC Name: (5S,6S,11R,17E)-17-benzylidene-4,7,12-trioxatrispiro[4.0.4^{6}.0.4^{11}.3^{5}]octadecan-16-one Traditional Name: (5S,6S,11R,17E)-17-benzal-4,7,12-trioxatrispiro[4.0.4^{6}.0.4^{11}.3^{5}]octadecan-16-one Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC(=CC3=CC=CC=C3)C(=O)C4(C25CCCO5)CCCO4)OC1

Isomeric SMILES

C1C[C@@]2(C/C(=C\C3=CC=CC=C3)/C(=O)[C@]4([C@]25CCCO5)CCCO4)OC1

InChI

InChI=1S/C22H26O4/c23-19-18(15-17-7-2-1-3-8-17)16-20(9-4-12-24-20)22(11-6-14-26-22)21(19)10-5-13-25-21/h1-3,7-8,15H,4-6,9-14,16H2/b18-15+/t20-,21-,22-/m0/s1