[2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate Openeye Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxo-ethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate CAS Name: 7-methyl-2-imidazo[1,2-a]pyridinecarboxylic acid [2-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxoethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 7-methylimidazo[1,2-a]pyridine-2-carboxylic acid [2-[4-(isovalerylamino)phenyl]-2-keto-ethyl] ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=CN2C=C1)C(=O)OCC(=O)C3=CC=C(C=C3)NC(=O)CC(C)C

Isomeric SMILES

CC1=CC2=NC(=CN2C=C1)C(=O)OCC(=O)C3=CC=C(C=C3)NC(=O)CC(C)C

InChI

InChI=1S/C22H23N3O4/c1-14(2)10-21(27)23-17-6-4-16(5-7-17)19(26)13-29-22(28)18-12-25-9-8-15(3)11-20(25)24-18/h4-9,11-12,14H,10,13H2,1-3H3,(H,23,27)