2,5-bis(2-tert-butyl-1H-indol-3-yl)-3,6-bis(oxidanyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,5-bis(2-tert-butyl-1H-indol-3-yl)-3,6-bis(oxidanyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-bis(2-tert-butyl-1H-indol-3-yl)-3,6-dihydroxy-1,4-benzoquinone CAS Name: 2,5-bis(2-tert-butyl-1H-indol-3-yl)-3,6-dihydroxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,5-bis(2-tert-butyl-1H-indol-3-yl)-3,6-dihydroxycyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-bis(2-tert-butyl-1H-indol-3-yl)-3,6-dihydroxy-p-benzoquinone Formula: C30H30N2O4 MolecularWeight: 482.5702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)O)C4=C(NC5=CC=CC=C54)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)O)C4=C(NC5=CC=CC=C54)C(C)(C)C)O

InChI

InChI=1S/C30H30N2O4/c1-29(2,3)27-19(15-11-7-9-13-17(15)31-27)21-23(33)25(35)22(26(36)24(21)34)20-16-12-8-10-14-18(16)32-28(20)30(4,5)6/h7-14,31-33,36H,1-6H3