N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide CAS Name: N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]-4-nitrobenzamide IUPAC Name: N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide Traditional Name: N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide Formula: C18H21N5O6 MolecularWeight: 403.38924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(CC(=O)NC2=NOC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCN(CC(=O)NC2=NOC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O6/c24-17(19-16-5-10-29-20-16)13-22(7-6-21-8-11-28-12-9-21)18(25)14-1-3-15(4-2-14)23(26)27/h1-5,10H,6-9,11-13H2,(H,19,20,24)