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

Systemtic Name: N-butyl-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: N-butyl-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-butyl-N-[2-(3-isoxazolylamino)-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-butyl-4-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide Traditional Name: N-butyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-4-nitro-benzamide Formula: C16H18N4O5 MolecularWeight: 346.33792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=NOC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)NC1=NOC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5/c1-2-3-9-19(11-15(21)17-14-8-10-25-18-14)16(22)12-4-6-13(7-5-12)20(23)24/h4-8,10H,2-3,9,11H2,1H3,(H,17,18,21)