N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-naphthylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-naphthalenylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-naphthylsulfonyl)isonipecotamide Formula: C25H26N2O5S MolecularWeight: 466.54934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)OC1

InChI

InChI=1S/C25H26N2O5S/c28-25(26-21-7-9-23-24(17-21)32-15-3-14-31-23)19-10-12-27(13-11-19)33(29,30)22-8-6-18-4-1-2-5-20(18)16-22/h1-2,4-9,16-17,19H,3,10-15H2,(H,26,28)