3-(4-chloranyl-3-nitro-phenyl)azanidylsulfonyl-4,5-dimethyl-benzoate

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)azanidylsulfonyl-4,5-dimethyl-benzoate Openeye Name: 3-(4-chloro-3-nitro-phenyl)azanidylsulfonyl-4,5-dimethyl-benzoate CAS Name: 3-(4-chloro-3-nitrophenyl)azanidylsulfonyl-4,5-dimethylbenzoate IUPAC Name: 3-(4-chloro-3-nitrophenyl)azanidylsulfonyl-4,5-dimethylbenzoate Traditional Name: 3-(4-chloro-3-nitro-phenyl)azanidylsulfonyl-4,5-dimethyl-benzoate Formula: C15H11ClN2O6S-2 MolecularWeight: 382.77564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)[N-]C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)[N-]C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C15H12ClN2O6S/c1-8-5-10(15(19)20)6-14(9(8)2)25(23,24)17-11-3-4-12(16)13(7-11)18(21)22/h3-7H,1-2H3,(H,19,20)/q-1/p-1