4-[bis(2-methoxyethyl)amino]-3,5-dinitro-benzenesulfonamide

Systemtic Name: 4-[bis(2-methoxyethyl)amino]-3,5-dinitro-benzenesulfonamide Openeye Name: 4-[bis(2-methoxyethyl)amino]-3,5-dinitro-benzenesulfonamide CAS Name: 4-[bis(2-methoxyethyl)amino]-3,5-dinitrobenzenesulfonamide IUPAC Name: 4-[bis(2-methoxyethyl)amino]-3,5-dinitrobenzenesulfonamide Traditional Name: 4-[bis(2-methoxyethyl)amino]-3,5-dinitro-benzenesulfonamide Formula: C12H18N4O8S MolecularWeight: 378.35832

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

COCCN(CCOC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O8S/c1-23-5-3-14(4-6-24-2)12-10(15(17)18)7-9(25(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)