2-methoxy-3,6-bis[1-(2-methylbutan-2-yl)indol-3-yl]-5-oxidanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-methoxy-3,6-bis[1-(2-methylbutan-2-yl)indol-3-yl]-5-oxidanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-bis[1-(1,1-dimethylpropyl)indol-3-yl]-3-hydroxy-6-methoxy-1,4-benzoquinone CAS Name: 2-hydroxy-5-methoxy-3,6-bis[1-(2-methylbutan-2-yl)-3-indolyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-hydroxy-5-methoxy-3,6-bis[1-(2-methylbutan-2-yl)indol-3-yl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-bis(1-tert-amylindol-3-yl)-3-hydroxy-6-methoxy-p-benzoquinone Formula: C33H36N2O4 MolecularWeight: 524.64994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N1C=C(C2=CC=CC=C21)C3=C(C(=O)C(=C(C3=O)OC)C4=CN(C5=CC=CC=C54)C(C)(C)CC)O

Isomeric SMILES

CCC(C)(C)N1C=C(C2=CC=CC=C21)C3=C(C(=O)C(=C(C3=O)OC)C4=CN(C5=CC=CC=C54)C(C)(C)CC)O

InChI

InChI=1S/C33H36N2O4/c1-8-32(3,4)34-18-22(20-14-10-12-16-24(20)34)26-28(36)29(37)27(31(39-7)30(26)38)23-19-35(33(5,6)9-2)25-17-13-11-15-21(23)25/h10-19,36H,8-9H2,1-7H3