ethyl N-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]carbamate

Systemtic Name: ethyl N-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]carbamate Openeye Name: ethyl N-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]carbamate CAS Name: N-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]carbamate Traditional Name: N-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoylamino]carbamic acid ethyl ester Formula: C14H16N4O7 MolecularWeight: 352.29944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CCOC(=O)NNC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C14H16N4O7/c1-2-24-13(20)16-15-12(19)4-3-7-17-10-6-5-9(18(22)23)8-11(10)25-14(17)21/h5-6,8H,2-4,7H2,1H3,(H,15,19)(H,16,20)