imidazo[1,2-a]pyridin-2-ylmethyl 2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-isopentyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3-methylbutyl)-1,3-dioxo-5-isoindolecarboxylic acid 2-imidazo[1,2-a]pyridinylmethyl ester IUPAC Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(3-methylbutyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-isoamyl-1,3-diketo-isoindoline-5-carboxylic acid imidazo[1,2-a]pyridin-2-ylmethyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=N3

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C22H21N3O4/c1-14(2)8-10-25-20(26)17-7-6-15(11-18(17)21(25)27)22(28)29-13-16-12-24-9-4-3-5-19(24)23-16/h3-7,9,11-12,14H,8,10,13H2,1-2H3