2-butyl-5-(1H-indol-3-ylmethylidene)-2-methyl-1,3-dioxane-4,6-dione

Systemtic Name: 2-butyl-5-(1H-indol-3-ylmethylidene)-2-methyl-1,3-dioxane-4,6-dione Openeye Name: 2-butyl-5-(1H-indol-3-ylmethylene)-2-methyl-1,3-dioxane-4,6-dione CAS Name: 2-butyl-5-(1H-indol-3-ylmethylidene)-2-methyl-1,3-dioxane-4,6-dione IUPAC Name: 2-butyl-5-(1H-indol-3-ylmethylidene)-2-methyl-1,3-dioxane-4,6-dione Traditional Name: 2-butyl-5-(1H-indol-3-ylmethylene)-2-methyl-1,3-dioxane-4,6-quinone Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OC(=O)C(=CC2=CNC3=CC=CC=C32)C(=O)O1)C

Isomeric SMILES

CCCCC1(OC(=O)C(=CC2=CNC3=CC=CC=C32)C(=O)O1)C

InChI

InChI=1S/C18H19NO4/c1-3-4-9-18(2)22-16(20)14(17(21)23-18)10-12-11-19-15-8-6-5-7-13(12)15/h5-8,10-11,19H,3-4,9H2,1-2H3