N,N-dimethyl-4-[(E)-3-(3-nitro-4-piperidin-1-yl-phenyl)prop-2-enoyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-[(E)-3-(3-nitro-4-piperidin-1-yl-phenyl)prop-2-enoyl]benzenesulfonamide Openeye Name: N,N-dimethyl-4-[(E)-3-[3-nitro-4-(1-piperidyl)phenyl]prop-2-enoyl]benzenesulfonamide CAS Name: N,N-dimethyl-4-[(E)-3-[3-nitro-4-(1-piperidinyl)phenyl]-1-oxoprop-2-enyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-4-[(E)-3-(3-nitro-4-piperidin-1-ylphenyl)prop-2-enoyl]benzenesulfonamide Traditional Name: N,N-dimethyl-4-[(E)-3-(3-nitro-4-piperidino-phenyl)acryloyl]benzenesulfonamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O5S/c1-23(2)31(29,30)19-10-8-18(9-11-19)22(26)13-7-17-6-12-20(21(16-17)25(27)28)24-14-4-3-5-15-24/h6-13,16H,3-5,14-15H2,1-2H3/b13-7+