4-(1,3-dithiolan-2-yl)-N,N-diethyl-2,6-dinitro-aniline

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N,N-diethyl-2,6-dinitro-aniline Openeye Name: 4-(1,3-dithiolan-2-yl)-N,N-diethyl-2,6-dinitro-aniline CAS Name: 4-(1,3-dithiolan-2-yl)-N,N-diethyl-2,6-dinitroaniline IUPAC Name: 4-(1,3-dithiolan-2-yl)-N,N-diethyl-2,6-dinitroaniline Traditional Name: [4-(1,3-dithiolan-2-yl)-2,6-dinitro-phenyl]-diethyl-amine Formula: C13H17N3O4S2 MolecularWeight: 343.42178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C2SCCS2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C2SCCS2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4S2/c1-3-14(4-2)12-10(15(17)18)7-9(8-11(12)16(19)20)13-21-5-6-22-13/h7-8,13H,3-6H2,1-2H3