1-(2-chloranyl-5-nitro-phenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-1,4-diazepane Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-1,4-diazepane CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-1,4-diazepane Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-1,4-diazepane Formula: C11H14ClN3O4S MolecularWeight: 319.76456

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CNCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H14ClN3O4S/c12-10-3-2-9(15(16)17)8-11(10)20(18,19)14-6-1-4-13-5-7-14/h2-3,8,13H,1,4-7H2