1-(4-chloranyl-3-nitro-phenyl)sulfonylazepane

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonylazepane Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonylazepane CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonylazepane IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonylazepane Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonylazepane Formula: C12H15ClN2O4S MolecularWeight: 318.7765

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN2O4S/c13-11-6-5-10(9-12(11)15(16)17)20(18,19)14-7-3-1-2-4-8-14/h5-6,9H,1-4,7-8H2