N-cyclooctyl-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-cyclooctyl-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-cyclooctyl-benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-cyclooctylbenzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-cyclooctylbenzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-cyclooctyl-benzamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H35N3O3S/c30-26(27-24-9-5-2-1-3-6-10-24)23-15-13-22(14-16-23)21-28-17-19-29(20-18-28)33(31,32)25-11-7-4-8-12-25/h4,7-8,11-16,24H,1-3,5-6,9-10,17-21H2,(H,27,30)