3-methyl-3-oxidanyl-2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-2H-naphthalene-1,4-dione

Systemtic Name: 3-methyl-3-oxidanyl-2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-2H-naphthalene-1,4-dione Openeye Name: 2-hydroxy-2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]tetralin-1,4-dione CAS Name: 3-hydroxy-3-methyl-2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-2H-naphthalene-1,4-dione IUPAC Name: 3-hydroxy-3-methyl-2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-2H-naphthalene-1,4-dione Traditional Name: 2-hydroxy-2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]tetralin-1,4-quinone Formula: C31H48O3 MolecularWeight: 468.71102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(=CCC1C(=O)C2=CC=CC=C2C(=O)C1(C)O)C

Isomeric SMILES

C[C@@H](CCC[C@@H](C)CCC/C(=C/CC1C(=O)C2=CC=CC=C2C(=O)C1(C)O)/C)CCCC(C)C

InChI

InChI=1S/C31H48O3/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-28-29(32)26-18-7-8-19-27(26)30(33)31(28,6)34/h7-8,18-20,22-24,28,34H,9-17,21H2,1-6H3/b25-20+/t23-,24-,28?,31?/m1/s1