methyl 2-[[(4-methyl-3-nitro-phenyl)carbonyl-pentyl-amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-methyl-3-nitro-phenyl)carbonyl-pentyl-amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(4-methyl-3-nitro-benzoyl)-pentyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(4-methyl-3-nitrophenyl)-oxomethyl]-pentylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-methyl-3-nitrobenzoyl)-pentylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[amyl-(4-methyl-3-nitro-benzoyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CO1)C(=O)OC)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CC1=NC(=CO1)C(=O)OC)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O6/c1-4-5-6-9-21(11-17-20-15(12-28-17)19(24)27-3)18(23)14-8-7-13(2)16(10-14)22(25)26/h7-8,10,12H,4-6,9,11H2,1-3H3