N-butyl-4-(1,3-dithian-2-yl)-2,6-dinitro-N-propyl-aniline

Systemtic Name: N-butyl-4-(1,3-dithian-2-yl)-2,6-dinitro-N-propyl-aniline Openeye Name: N-butyl-4-(1,3-dithian-2-yl)-2,6-dinitro-N-propyl-aniline CAS Name: N-butyl-4-(1,3-dithian-2-yl)-2,6-dinitro-N-propylaniline IUPAC Name: N-butyl-4-(1,3-dithian-2-yl)-2,6-dinitro-N-propylaniline Traditional Name: butyl-[4-(1,3-dithian-2-yl)-2,6-dinitro-phenyl]-propyl-amine Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C2SCCCS2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C2SCCCS2)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4S2/c1-3-5-8-18(7-4-2)16-14(19(21)22)11-13(12-15(16)20(23)24)17-25-9-6-10-26-17/h11-12,17H,3-10H2,1-2H3