1-[5-chloranyl-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]phenyl]carbonylpiperidine-3-carboxamide

Systemtic Name: 1-[5-chloranyl-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]phenyl]carbonylpiperidine-3-carboxamide Openeye Name: 1-[5-chloro-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide CAS Name: 1-[[5-chloro-2-[(2,3-dimethyl-5-nitrophenyl)sulfonylamino]phenyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: 1-[5-chloro-2-[(2,3-dimethyl-5-nitrophenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide Traditional Name: 1-[5-chloro-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]benzoyl]nipecotamide Formula: C21H23ClN4O6S MolecularWeight: 494.94852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)N3CCCC(C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)N3CCCC(C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O6S/c1-12-8-16(26(29)30)10-19(13(12)2)33(31,32)24-18-6-5-15(22)9-17(18)21(28)25-7-3-4-14(11-25)20(23)27/h5-6,8-10,14,24H,3-4,7,11H2,1-2H3,(H2,23,27)