2-chloranyl-N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-5-nitro-benzamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H18ClN3O5S/c1-2-14-3-10-18(11-4-14)31(29,30)24-16-7-5-15(6-8-16)23-21(26)19-13-17(25(27)28)9-12-20(19)22/h3-13,24H,2H2,1H3,(H,23,26)