N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C23H26N2O5S MolecularWeight: 442.52794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O5S/c26-23(24-16-20-17-29-21-8-4-5-9-22(21)30-20)19-10-13-25(14-11-19)31(27,28)15-12-18-6-2-1-3-7-18/h1-9,12,15,19-20H,10-11,13-14,16-17H2,(H,24,26)/b15-12+