2-(1-methylindol-3-yl)-3,6-bis(oxidanyl)-5-phenyl-cyclohexane-1,4-dione

Systemtic Name: 2-(1-methylindol-3-yl)-3,6-bis(oxidanyl)-5-phenyl-cyclohexane-1,4-dione Openeye Name: 2,5-dihydroxy-3-(1-methylindol-3-yl)-6-phenyl-cyclohexane-1,4-dione CAS Name: 2,5-dihydroxy-3-(1-methyl-3-indolyl)-6-phenylcyclohexane-1,4-dione IUPAC Name: 2,5-dihydroxy-3-(1-methylindol-3-yl)-6-phenylcyclohexane-1,4-dione Traditional Name: 2,5-dihydroxy-3-(1-methylindol-3-yl)-6-phenyl-cyclohexane-1,4-quinone Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3C(C(=O)C(C(C3=O)O)C4=CC=CC=C4)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3C(C(=O)C(C(C3=O)O)C4=CC=CC=C4)O

InChI

InChI=1S/C21H19NO4/c1-22-11-14(13-9-5-6-10-15(13)22)17-20(25)18(23)16(19(24)21(17)26)12-7-3-2-4-8-12/h2-11,16-18,21,23,26H,1H3