2-chloranyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-4-nitrobenzamide Traditional Name: 2-chloro-N-(4-methyl-3-piperidinosulfonyl-phenyl)-4-nitro-benzamide Formula: C19H20ClN3O5S MolecularWeight: 437.8972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H20ClN3O5S/c1-13-5-6-14(11-18(13)29(27,28)22-9-3-2-4-10-22)21-19(24)16-8-7-15(23(25)26)12-17(16)20/h5-8,11-12H,2-4,9-10H2,1H3,(H,21,24)