2-[4-ethyl-3-methyl-1-(2-methylpropanoyl)cinnolin-2-yl]-2-methyl-propanoic acid

Systemtic Name: 2-[4-ethyl-3-methyl-1-(2-methylpropanoyl)cinnolin-2-yl]-2-methyl-propanoic acid Openeye Name: 2-[4-ethyl-3-methyl-1-(2-methylpropanoyl)cinnolin-2-yl]-2-methyl-propanoic acid CAS Name: 2-[4-ethyl-3-methyl-1-(2-methyl-1-oxopropyl)-2-cinnolinyl]-2-methylpropanoic acid IUPAC Name: 2-[4-ethyl-3-methyl-1-(2-methylpropanoyl)cinnolin-2-yl]-2-methylpropanoic acid Traditional Name: 2-(4-ethyl-1-isobutyryl-3-methyl-cinnolin-2-yl)-2-methyl-propionic acid Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N(C2=CC=CC=C21)C(=O)C(C)C)C(C)(C)C(=O)O)C

Isomeric SMILES

CCC1=C(N(N(C2=CC=CC=C21)C(=O)C(C)C)C(C)(C)C(=O)O)C

InChI

InChI=1S/C19H26N2O3/c1-7-14-13(4)21(19(5,6)18(23)24)20(17(22)12(2)3)16-11-9-8-10-15(14)16/h8-12H,7H2,1-6H3,(H,23,24)