3-(hydroxymethyl)-5-methoxy-1-methyl-2-[(E)-3-oxidanylprop-1-enyl]indole-4,7-dione

Systemtic Name: 3-(hydroxymethyl)-5-methoxy-1-methyl-2-[(E)-3-oxidanylprop-1-enyl]indole-4,7-dione Openeye Name: 3-(hydroxymethyl)-2-[(E)-3-hydroxyprop-1-enyl]-5-methoxy-1-methyl-indole-4,7-dione CAS Name: 3-(hydroxymethyl)-2-[(E)-3-hydroxyprop-1-enyl]-5-methoxy-1-methylindole-4,7-dione IUPAC Name: 3-(hydroxymethyl)-2-[(E)-3-hydroxyprop-1-enyl]-5-methoxy-1-methylindole-4,7-dione Traditional Name: 2-[(E)-3-hydroxyprop-1-enyl]-5-methoxy-1-methyl-3-methylol-indole-4,7-quinone Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO5/c1-15-9(4-3-5-16)8(7-17)12-13(15)10(18)6-11(20-2)14(12)19/h3-4,6,16-17H,5,7H2,1-2H3/b4-3+