1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylazocane

Systemtic Name: 1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylazocane Openeye Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylazocane CAS Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonylazocane IUPAC Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonylazocane Traditional Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylazocane Formula: C14H19ClN2O4S MolecularWeight: 346.82966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCCCCCC2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCCCCCC2)Cl

InChI

InChI=1S/C14H19ClN2O4S/c1-11-13(15)9-12(10-14(11)17(18)19)22(20,21)16-7-5-3-2-4-6-8-16/h9-10H,2-8H2,1H3