2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-3-oxidanylideneprop-1-enyl]benzoic acid

Systemtic Name: 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-3-oxidanylideneprop-1-enyl]benzoic acid Openeye Name: 2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-5-[(E)-3-oxoprop-1-enyl]benzoic acid CAS Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-[(E)-3-ketoprop-1-enyl]benzoic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=C(C=C(C=C2)C=CC=O)C(=O)O)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=C(C=C(C=C2)/C=C/C=O)C(=O)O)C

InChI

InChI=1S/C17H18N2O4/c1-10(2)17(3)16(23)18-14(19-17)12-7-6-11(5-4-8-20)9-13(12)15(21)22/h4-10H,1-3H3,(H,21,22)(H,18,19,23)/b5-4+