diethyl-[5-(iodanylmethyl)-1,3-thiazolidin-2-ylidene]azanium; 2,4,6-trinitrophenolate

Systemtic Name: diethyl-[5-(iodanylmethyl)-1,3-thiazolidin-2-ylidene]azanium; 2,4,6-trinitrophenolate Openeye Name: diethyl-[5-(iodomethyl)thiazolidin-2-ylidene]ammonium; 2,4,6-trinitrophenolate CAS Name: diethyl-[5-(iodomethyl)-2-thiazolidinylidene]ammonium; 2,4,6-trinitrophenolate IUPAC Name: diethyl-[5-(iodomethyl)-1,3-thiazolidin-2-ylidene]azanium; 2,4,6-trinitrophenolate Traditional Name: diethyl-[5-(iodomethyl)thiazolidin-2-ylidene]ammonium picrate Formula: C14H18IN5O7S MolecularWeight: 527.29149

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C1NCC(S1)CI)CC.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC[N+](=C1NCC(S1)CI)CC.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H15IN2S.C6H3N3O7/c1-3-11(4-2)8-10-6-7(5-9)12-8;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7H,3-6H2,1-2H3;1-2,10H