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

Systemtic Name: 2-chloranyl-N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-chloro-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide CAS Name: 2-chloro-N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide Traditional Name: 2-chloro-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide Formula: C18H20ClN5O6 MolecularWeight: 437.8343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN5O6/c19-15-11-13(24(27)28)1-2-14(15)18(26)23(5-4-22-6-9-29-10-7-22)12-17(25)20-16-3-8-30-21-16/h1-3,8,11H,4-7,9-10,12H2,(H,20,21,25)