2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-2-phenylethenyl]pyridine-3-carboxylic acid

Systemtic Name: 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-2-phenylethenyl]pyridine-3-carboxylic acid Openeye Name: 2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-5-[(E)-styryl]pyridine-3-carboxylic acid CAS Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-2-phenylethenyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-[(E)-2-phenylethenyl]pyridine-3-carboxylic acid Traditional Name: 2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-[(E)-styryl]nicotinic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=C(C=C(C=N2)C=CC3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=C(C=C(C=N2)/C=C/C3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C21H21N3O3/c1-13(2)21(3)20(27)23-18(24-21)17-16(19(25)26)11-15(12-22-17)10-9-14-7-5-4-6-8-14/h4-13H,1-3H3,(H,25,26)(H,23,24,27)/b10-9+