2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-3-methyl-pentanoic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-3-methyl-pentanoic acid Openeye Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-3-methyl-pentanoic acid CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-3-methylpentanoic acid IUPAC Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-3-methylpentanoic acid Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)-3-methyl-valeric acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

CCC(C)C(C(=O)O)N1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C15H17NO4/c1-3-9(2)13(15(19)20)16-12(17)8-10-6-4-5-7-11(10)14(16)18/h4-7,9,13H,3,8H2,1-2H3,(H,19,20)