2-azanylethyl nitrate; 4-methylbenzenesulfonic acid

Systemtic Name: 2-azanylethyl nitrate; 4-methylbenzenesulfonic acid Openeye Name: 2-aminoethyl nitrate; 4-methylbenzenesulfonic acid CAS Name: 4-methylbenzenesulfonic acid; nitric acid 2-aminoethyl ester IUPAC Name: 2-aminoethyl nitrate; 4-methylbenzenesulfonic acid Traditional Name: nitric acid 2-aminoethyl ester; tosylic acid Formula: C9H14N2O6S MolecularWeight: 278.28226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C(CO[N+](=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C(CO[N+](=O)[O-])N

InChI

InChI=1S/C7H8O3S.C2H6N2O3/c1-6-2-4-7(5-3-6)11(8,9)10;3-1-2-7-4(5)6/h2-5H,1H3,(H,8,9,10);1-3H2