methyl 1-(2-methylpropyl)-2-oxidanylidene-3-prop-2-enyl-benzimidazole-5-carboxylate

Systemtic Name: methyl 1-(2-methylpropyl)-2-oxidanylidene-3-prop-2-enyl-benzimidazole-5-carboxylate Openeye Name: methyl 3-allyl-1-isobutyl-2-oxo-benzimidazole-5-carboxylate CAS Name: 1-(2-methylpropyl)-2-oxo-3-prop-2-enyl-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-methylpropyl)-2-oxo-3-prop-2-enylbenzimidazole-5-carboxylate Traditional Name: 3-allyl-1-isobutyl-2-keto-benzimidazole-5-carboxylic acid methyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)C(=O)OC)N(C1=O)CC=C

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)C(=O)OC)N(C1=O)CC=C

InChI

InChI=1S/C16H20N2O3/c1-5-8-17-14-9-12(15(19)21-4)6-7-13(14)18(16(17)20)10-11(2)3/h5-7,9,11H,1,8,10H2,2-4H3