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

Systemtic Name: 2-methoxy-3,6-bis[2-(3-methylbutyl)-1H-indol-3-yl]-5-oxidanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-hydroxy-3,6-bis(2-isopentyl-1H-indol-3-yl)-5-methoxy-1,4-benzoquinone CAS Name: 2-hydroxy-5-methoxy-3,6-bis[2-(3-methylbutyl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-hydroxy-5-methoxy-3,6-bis[2-(3-methylbutyl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-hydroxy-3,6-bis(2-isoamyl-1H-indol-3-yl)-5-methoxy-p-benzoquinone Formula: C33H36N2O4 MolecularWeight: 524.64994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)OC)C4=C(NC5=CC=CC=C54)CCC(C)C)O

Isomeric SMILES

CC(C)CCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)OC)C4=C(NC5=CC=CC=C54)CCC(C)C)O

InChI

InChI=1S/C33H36N2O4/c1-18(2)14-16-24-26(20-10-6-8-12-22(20)34-24)28-30(36)31(37)29(33(39-5)32(28)38)27-21-11-7-9-13-23(21)35-25(27)17-15-19(3)4/h6-13,18-19,34-36H,14-17H2,1-5H3