2-[(2,4,6-trinitrophenyl)amino]ethyl methanesulfonate

Systemtic Name: 2-[(2,4,6-trinitrophenyl)amino]ethyl methanesulfonate Openeye Name: 2-(2,4,6-trinitroanilino)ethyl methanesulfonate CAS Name: methanesulfonic acid 2-(2,4,6-trinitroanilino)ethyl ester IUPAC Name: 2-(2,4,6-trinitroanilino)ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-(2,4,6-trinitroanilino)ethyl ester Formula: C9H10N4O9S MolecularWeight: 350.2621

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCNC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OCCNC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H10N4O9S/c1-23(20,21)22-3-2-10-9-7(12(16)17)4-6(11(14)15)5-8(9)13(18)19/h4-5,10H,2-3H2,1H3