N-(3-chloranyl-2-methyl-phenyl)-1-(2-chloranyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-(2-chloranyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-(2-chloro-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-1-(2-chloro-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-(2-chloro-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-1-(2-chloro-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C19H19Cl2N3O5S MolecularWeight: 472.34226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19Cl2N3O5S/c1-12-15(20)3-2-4-17(12)22-19(25)13-7-9-23(10-8-13)30(28,29)18-11-14(24(26)27)5-6-16(18)21/h2-6,11,13H,7-10H2,1H3,(H,22,25)