methyl 5-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate

Systemtic Name: methyl 5-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate Openeye Name: methyl 5-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]isoxazole-3-carboxylate CAS Name: 5-[(2-butyl-4-methyl-1-benzimidazolyl)methyl]-3-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-butyl-4-methylbenzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]isoxazole-3-carboxylic acid methyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=CC=C2N1CC3=CC(=NO3)C(=O)OC)C

Isomeric SMILES

CCCCC1=NC2=C(C=CC=C2N1CC3=CC(=NO3)C(=O)OC)C

InChI

InChI=1S/C18H21N3O3/c1-4-5-9-16-19-17-12(2)7-6-8-15(17)21(16)11-13-10-14(20-24-13)18(22)23-3/h6-8,10H,4-5,9,11H2,1-3H3