N,2-dimethyl-N-[1-(3-nitrophenyl)ethyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N,2-dimethyl-N-[1-(3-nitrophenyl)ethyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N,2-dimethyl-N-[1-(3-nitrophenyl)ethyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: N,2-dimethyl-N-[1-(3-nitrophenyl)ethyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N,2-dimethyl-N-[1-(3-nitrophenyl)ethyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N,2-dimethyl-N-[1-(3-nitrophenyl)ethyl]-5-piperidinosulfonyl-benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O5S/c1-16-10-11-20(31(29,30)24-12-5-4-6-13-24)15-21(16)22(26)23(3)17(2)18-8-7-9-19(14-18)25(27)28/h7-11,14-15,17H,4-6,12-13H2,1-3H3