2-nitroethyl [1-(3-aminophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethanoate

Systemtic Name: 2-nitroethyl [1-(3-aminophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethanoate Openeye Name: 2-nitroethyl [1-(3-aminophenyl)tetrazol-5-yl]sulfanylformate CAS Name: [[1-(3-aminophenyl)-5-tetrazolyl]thio]formic acid 2-nitroethyl ester IUPAC Name: 2-nitroethyl [1-(3-aminophenyl)tetrazol-5-yl]sulfanylformate Traditional Name: [[1-(3-aminophenyl)tetrazol-5-yl]thio]formic acid 2-nitroethyl ester Formula: C10H10N6O4S MolecularWeight: 310.2892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)N2C(=NN=N2)SC(=O)OCC[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N)N2C(=NN=N2)SC(=O)OCC[N+](=O)[O-]

InChI

InChI=1S/C10H10N6O4S/c11-7-2-1-3-8(6-7)16-9(12-13-14-16)21-10(17)20-5-4-15(18)19/h1-3,6H,4-5,11H2