methyl 5-[2-(3-methylbutylcarbamoyl)phenyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 5-[2-(3-methylbutylcarbamoyl)phenyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 5-[2-(isopentylcarbamoyl)phenyl]oxazole-4-carboxylate CAS Name: 5-[2-[(3-methylbutylamino)-oxomethyl]phenyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[2-(3-methylbutylcarbamoyl)phenyl]-1,3-oxazole-4-carboxylate Traditional Name: 5-[2-(isoamylcarbamoyl)phenyl]oxazole-4-carboxylic acid methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=CC=C1C2=C(N=CO2)C(=O)OC

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=CC=C1C2=C(N=CO2)C(=O)OC

InChI

InChI=1S/C17H20N2O4/c1-11(2)8-9-18-16(20)13-7-5-4-6-12(13)15-14(17(21)22-3)19-10-23-15/h4-7,10-11H,8-9H2,1-3H3,(H,18,20)