(6aR)-6,6-dimethyl-1-oxidanyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carbaldehyde

Systemtic Name: (6aR)-6,6-dimethyl-1-oxidanyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carbaldehyde Openeye Name: (6aR)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carbaldehyde CAS Name: (6aR)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c][1]benzopyran-9-carboxaldehyde IUPAC Name: (6aR)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carbaldehyde Traditional Name: (6aR)-3-amyl-1-hydroxy-6,6-dimethyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carbaldehyde Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)C=O)C(=C1)O

Isomeric SMILES

CCCCCC1=CC2=C(C3CC(=CC[C@H]3C(O2)(C)C)C=O)C(=C1)O

InChI

InChI=1S/C21H28O3/c1-4-5-6-7-14-11-18(23)20-16-10-15(13-22)8-9-17(16)21(2,3)24-19(20)12-14/h8,11-13,16-17,23H,4-7,9-10H2,1-3H3/t16?,17-/m1/s1