N-(cyclopropylmethyl)-5-[[(3-nitrophenyl)carbonyl-propyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-5-[[(3-nitrophenyl)carbonyl-propyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(cyclopropylmethyl)-5-[[(3-nitrobenzoyl)-propyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(cyclopropylmethyl)-5-[[[(3-nitrophenyl)-oxomethyl]-propylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(cyclopropylmethyl)-5-[[(3-nitrobenzoyl)-propylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(cyclopropylmethyl)-5-[[(3-nitrobenzoyl)-propyl-amino]methyl]isoxazole-3-carboxamide Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=NO1)C(=O)NCC2CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC(=NO1)C(=O)NCC2CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5/c1-2-8-22(19(25)14-4-3-5-15(9-14)23(26)27)12-16-10-17(21-28-16)18(24)20-11-13-6-7-13/h3-5,9-10,13H,2,6-8,11-12H2,1H3,(H,20,24)