3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-methoxy-5,7-dimethyl-naphthalene-1,4-dione

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-methoxy-5,7-dimethyl-naphthalene-1,4-dione Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-methoxy-5,7-dimethyl-naphthalene-1,4-dione CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-methoxy-5,7-dimethylnaphthalene-1,4-dione IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-methoxy-5,7-dimethylnaphthalene-1,4-dione Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-methoxy-5,7-dimethyl-1,4-naphthoquinone Formula: C27H32O4 MolecularWeight: 420.54058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(C2=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(C2=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)OC)C

InChI

InChI=1S/C27H32O4/c1-14-10-15(2)20-17(11-14)22(28)25(31-9)21(24(20)30)16-12-18(26(3,4)5)23(29)19(13-16)27(6,7)8/h10-13,29H,1-9H3