methyl 5-(2-methylpropyl)-1-(1-phenylethyl)imidazole-4-carboxylate

Systemtic Name: methyl 5-(2-methylpropyl)-1-(1-phenylethyl)imidazole-4-carboxylate Openeye Name: methyl 5-isobutyl-1-(1-phenylethyl)imidazole-4-carboxylate CAS Name: 5-(2-methylpropyl)-1-(1-phenylethyl)-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-methylpropyl)-1-(1-phenylethyl)imidazole-4-carboxylate Traditional Name: 5-isobutyl-1-(1-phenylethyl)imidazole-4-carboxylic acid methyl ester Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=CN1C(C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)CC1=C(N=CN1C(C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H22N2O2/c1-12(2)10-15-16(17(20)21-4)18-11-19(15)13(3)14-8-6-5-7-9-14/h5-9,11-13H,10H2,1-4H3