4-chloranyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-(3-methylpiperidino)sulfonylphenyl]-3-nitro-benzamide Formula: C19H20ClN3O5S MolecularWeight: 437.8972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O5S/c1-13-3-2-10-22(12-13)29(27,28)16-7-5-15(6-8-16)21-19(24)14-4-9-17(20)18(11-14)23(25)26/h4-9,11,13H,2-3,10,12H2,1H3,(H,21,24)