4-methyl-N-(3-nitrophenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methyl-N-(3-nitrophenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-methyl-N-(3-nitrophenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-methyl-N-(3-nitrophenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-methyl-N-(3-nitrophenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-methyl-N-(3-nitrophenyl)-3-piperidinosulfonyl-benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H21N3O5S/c1-14-8-9-15(12-18(14)28(26,27)21-10-3-2-4-11-21)19(23)20-16-6-5-7-17(13-16)22(24)25/h5-9,12-13H,2-4,10-11H2,1H3,(H,20,23)