[3-(2-nitrooxyethyl)-4-oxidanylidene-2H-1,3-benzoxazin-6-yl] N-ethylcarbamate

Systemtic Name: [3-(2-nitrooxyethyl)-4-oxidanylidene-2H-1,3-benzoxazin-6-yl] N-ethylcarbamate Openeye Name: [3-(2-nitrooxyethyl)-4-oxo-2H-1,3-benzoxazin-6-yl] N-ethylcarbamate CAS Name: N-ethylcarbamic acid [3-(2-nitrooxyethyl)-4-oxo-2H-1,3-benzoxazin-6-yl] ester IUPAC Name: [3-(2-nitrooxyethyl)-4-oxo-2H-1,3-benzoxazin-6-yl] N-ethylcarbamate Traditional Name: N-ethylcarbamic acid [4-keto-3-(2-nitrooxyethyl)-2H-1,3-benzoxazin-6-yl] ester Formula: C13H15N3O7 MolecularWeight: 325.2741

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)OC1=CC2=C(C=C1)OCN(C2=O)CCO[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)OC1=CC2=C(C=C1)OCN(C2=O)CCO[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O7/c1-2-14-13(18)23-9-3-4-11-10(7-9)12(17)15(8-21-11)5-6-22-16(19)20/h3-4,7H,2,5-6,8H2,1H3,(H,14,18)