4-azanyl-2-(3-methylbutanoyl)indene-1,3-dione

Systemtic Name: 4-azanyl-2-(3-methylbutanoyl)indene-1,3-dione Openeye Name: 4-amino-2-(3-methylbutanoyl)indane-1,3-dione CAS Name: 4-amino-2-(3-methyl-1-oxobutyl)indene-1,3-dione IUPAC Name: 4-amino-2-(3-methylbutanoyl)indene-1,3-dione Traditional Name: 4-amino-2-isovaleryl-indane-1,3-quinone Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1C(=O)C2=C(C1=O)C(=CC=C2)N

Isomeric SMILES

CC(C)CC(=O)C1C(=O)C2=C(C1=O)C(=CC=C2)N

InChI

InChI=1S/C14H15NO3/c1-7(2)6-10(16)12-13(17)8-4-3-5-9(15)11(8)14(12)18/h3-5,7,12H,6,15H2,1-2H3