(3aR,7aR)-6-[(E)-4-(2,5-dimethoxy-3-methyl-phenyl)-2-methyl-but-2-enyl]-3a,7a-dimethyl-5-(2-methyl-2-oxidanyl-propyl)-1,2,3,7-tetrahydroinden-4-one

Systemtic Name: (3aR,7aR)-6-[(E)-4-(2,5-dimethoxy-3-methyl-phenyl)-2-methyl-but-2-enyl]-3a,7a-dimethyl-5-(2-methyl-2-oxidanyl-propyl)-1,2,3,7-tetrahydroinden-4-one Openeye Name: (3aR,7aR)-6-[(E)-4-(2,5-dimethoxy-3-methyl-phenyl)-2-methyl-but-2-enyl]-5-(2-hydroxy-2-methyl-propyl)-3a,7a-dimethyl-1,2,3,7-tetrahydroinden-4-one CAS Name: (3aR,7aR)-6-[(E)-4-(2,5-dimethoxy-3-methylphenyl)-2-methylbut-2-enyl]-5-(2-hydroxy-2-methylpropyl)-3a,7a-dimethyl-1,2,3,7-tetrahydroinden-4-one IUPAC Name: (3aR,7aR)-6-[(E)-4-(2,5-dimethoxy-3-methylphenyl)-2-methylbut-2-enyl]-5-(2-hydroxy-2-methylpropyl)-3a,7a-dimethyl-1,2,3,7-tetrahydroinden-4-one Traditional Name: (3aR,7aR)-6-[(E)-4-(2,5-dimethoxy-3-methyl-phenyl)-2-methyl-but-2-enyl]-5-(2-hydroxy-2-methyl-propyl)-3a,7a-dimethyl-1,2,3,7-tetrahydroinden-4-one Formula: C29H42O4 MolecularWeight: 454.64138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)CC=C(C)CC2=C(C(=O)C3(CCCC3(C2)C)C)CC(C)(C)O)OC

Isomeric SMILES

CC1=CC(=CC(=C1OC)C/C=C(\C)/CC2=C(C(=O)[C@@]3(CCC[C@@]3(C2)C)C)CC(C)(C)O)OC

InChI

InChI=1S/C29H42O4/c1-19(10-11-21-16-23(32-7)15-20(2)25(21)33-8)14-22-17-28(5)12-9-13-29(28,6)26(30)24(22)18-27(3,4)31/h10,15-16,31H,9,11-14,17-18H2,1-8H3/b19-10+/t28-,29+/m1/s1