5-(hydroxymethyl)-5-(1H-indol-3-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-(hydroxymethyl)-5-(1H-indol-3-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-(hydroxymethyl)-5-(1H-indol-3-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-(hydroxymethyl)-5-(1H-indol-3-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-(hydroxymethyl)-5-(1H-indol-3-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-(1H-indol-3-ylmethyl)-2,2-dimethyl-5-methylol-1,3-dioxane-4,6-quinone Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC2=CNC3=CC=CC=C32)CO)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CC2=CNC3=CC=CC=C32)CO)C

InChI

InChI=1S/C16H17NO5/c1-15(2)21-13(19)16(9-18,14(20)22-15)7-10-8-17-12-6-4-3-5-11(10)12/h3-6,8,17-18H,7,9H2,1-2H3