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

Systemtic Name: 2-methyl-2-[4-methyl-1-(2-methylpropanoyl)-3-propan-2-yl-cinnolin-2-yl]propanoic acid Openeye Name: 2-[3-isopropyl-4-methyl-1-(2-methylpropanoyl)cinnolin-2-yl]-2-methyl-propanoic acid CAS Name: 2-methyl-2-[4-methyl-1-(2-methyl-1-oxopropyl)-3-propan-2-yl-2-cinnolinyl]propanoic acid IUPAC Name: 2-methyl-2-[4-methyl-1-(2-methylpropanoyl)-3-propan-2-ylcinnolin-2-yl]propanoic acid Traditional Name: 2-(1-isobutyryl-3-isopropyl-4-methyl-cinnolin-2-yl)-2-methyl-propionic acid Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N(C2=CC=CC=C12)C(=O)C(C)C)C(C)(C)C(=O)O)C(C)C

Isomeric SMILES

CC1=C(N(N(C2=CC=CC=C12)C(=O)C(C)C)C(C)(C)C(=O)O)C(C)C

InChI

InChI=1S/C20H28N2O3/c1-12(2)17-14(5)15-10-8-9-11-16(15)21(18(23)13(3)4)22(17)20(6,7)19(24)25/h8-13H,1-7H3,(H,24,25)