methyl 2-[[(3-nitrophenyl)carbonyl-propyl-amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[(3-nitrophenyl)carbonyl-propyl-amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(3-nitrobenzoyl)-propyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(3-nitrophenyl)-oxomethyl]-propylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-nitrobenzoyl)-propylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[(3-nitrobenzoyl)-propyl-amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O6/c1-3-7-18(9-14-17-13(10-25-14)16(21)24-2)15(20)11-5-4-6-12(8-11)19(22)23/h4-6,8,10H,3,7,9H2,1-2H3