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

Systemtic Name: 4-chloranyl-N-(3-ethoxypropyl)-3-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-chloro-N-(3-ethoxypropyl)-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-(3-ethoxypropyl)-N-[2-(3-isoxazolylamino)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-(3-ethoxypropyl)-3-nitro-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide Traditional Name: 4-chloro-N-(3-ethoxypropyl)-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-3-nitro-benzamide Formula: C17H19ClN4O6 MolecularWeight: 410.80896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN4O6/c1-2-27-8-3-7-21(11-16(23)19-15-6-9-28-20-15)17(24)12-4-5-13(18)14(10-12)22(25)26/h4-6,9-10H,2-3,7-8,11H2,1H3,(H,19,20,23)