2-[2-[(2-methyl-5-oxidanylidene-1-phenyl-4-propan-2-yl-pyrazol-3-yl)methylcarbamoyl]phenyl]ethanoic acid

Systemtic Name: 2-[2-[(2-methyl-5-oxidanylidene-1-phenyl-4-propan-2-yl-pyrazol-3-yl)methylcarbamoyl]phenyl]ethanoic acid Openeye Name: 2-[2-[(4-isopropyl-2-methyl-5-oxo-1-phenyl-pyrazol-3-yl)methylcarbamoyl]phenyl]acetic acid CAS Name: 2-[2-[[(2-methyl-5-oxo-1-phenyl-4-propan-2-yl-3-pyrazolyl)methylamino]-oxomethyl]phenyl]acetic acid IUPAC Name: 2-[2-[(2-methyl-5-oxo-1-phenyl-4-propan-2-ylpyrazol-3-yl)methylcarbamoyl]phenyl]acetic acid Traditional Name: 2-[2-[(4-isopropyl-5-keto-2-methyl-1-phenyl-3-pyrazolin-3-yl)methylcarbamoyl]phenyl]acetic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(N(C1=O)C2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3CC(=O)O

Isomeric SMILES

CC(C)C1=C(N(N(C1=O)C2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3CC(=O)O

InChI

InChI=1S/C23H25N3O4/c1-15(2)21-19(25(3)26(23(21)30)17-10-5-4-6-11-17)14-24-22(29)18-12-8-7-9-16(18)13-20(27)28/h4-12,15H,13-14H2,1-3H3,(H,24,29)(H,27,28)