methyl 2-[[(4-ethoxyphenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-ethoxyphenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(4-ethoxyphenyl)carbamoyl-isopentyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(4-ethoxyanilino)-oxomethyl]-(3-methylbutyl)amino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-ethoxyphenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[isoamyl(p-phenetylcarbamoyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N(CCC(C)C)CC2=NC(=CO2)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N(CCC(C)C)CC2=NC(=CO2)C(=O)OC

InChI

InChI=1S/C20H27N3O5/c1-5-27-16-8-6-15(7-9-16)21-20(25)23(11-10-14(2)3)12-18-22-17(13-28-18)19(24)26-4/h6-9,13-14H,5,10-12H2,1-4H3,(H,21,25)