3-(hydroxymethyl)-5-methoxy-1-methyl-indole-4,7-dione

Systemtic Name: 3-(hydroxymethyl)-5-methoxy-1-methyl-indole-4,7-dione Openeye Name: 3-(hydroxymethyl)-5-methoxy-1-methyl-indole-4,7-dione CAS Name: 3-(hydroxymethyl)-5-methoxy-1-methylindole-4,7-dione IUPAC Name: 3-(hydroxymethyl)-5-methoxy-1-methylindole-4,7-dione Traditional Name: 5-methoxy-1-methyl-3-methylol-indole-4,7-quinone Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C(=O)C=C(C2=O)OC)CO

Isomeric SMILES

CN1C=C(C2=C1C(=O)C=C(C2=O)OC)CO

InChI

InChI=1S/C11H11NO4/c1-12-4-6(5-13)9-10(12)7(14)3-8(16-2)11(9)15/h3-4,13H,5H2,1-2H3