N-(1-azanylethyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide

Systemtic Name: N-(1-azanylethyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide Openeye Name: N-(1-aminoethyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide CAS Name: N-(1-aminoethyl)-2-nitro-N-(2-nitrophenyl)sulfonylbenzenesulfonamide IUPAC Name: N-(1-aminoethyl)-2-nitro-N-(2-nitrophenyl)sulfonylbenzenesulfonamide Traditional Name: N-(1-aminoethyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide Formula: C14H14N4O8S2 MolecularWeight: 430.41296

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Descriptors Computed from Structure

Canonical SMILES:

CC(N)N(S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(N)N(S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O8S2/c1-10(15)18(27(23,24)13-8-4-2-6-11(13)16(19)20)28(25,26)14-9-5-3-7-12(14)17(21)22/h2-10H,15H2,1H3