[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: [2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: [2-(isoxazol-3-ylamino)-2-oxo-ethyl] 2-[(4-chloro-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]acetic acid [2-(3-isoxazolylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,2-oxazol-3-ylamino)-2-oxoethyl] 2-[(4-chloro-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]acetic acid [2-(isoxazol-3-ylamino)-2-keto-ethyl] ester Formula: C14H11ClN4O7 MolecularWeight: 382.71274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCC(=O)OCC(=O)NC2=NOC=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCC(=O)OCC(=O)NC2=NOC=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H11ClN4O7/c15-9-2-1-8(5-10(9)19(23)24)14(22)16-6-13(21)25-7-12(20)17-11-3-4-26-18-11/h1-5H,6-7H2,(H,16,22)(H,17,18,20)