5-[6-oxidanylidene-8-[2-(phenylsulfonylamino)propylcarbamoyl]quinolizin-2-yl]oxypentylcarbamoylboron

Systemtic Name: 5-[6-oxidanylidene-8-[2-(phenylsulfonylamino)propylcarbamoyl]quinolizin-2-yl]oxypentylcarbamoylboron Openeye Name: 5-[8-[2-(benzenesulfonamido)propylcarbamoyl]-6-oxo-quinolizin-2-yl]oxypentylcarbamoylboron CAS Name: [[5-[[8-[[2-(benzenesulfonamido)propylamino]-oxomethyl]-6-oxo-2-quinolizinyl]oxy]pentylamino]-oxomethyl]boron IUPAC Name: 5-[8-[2-(benzenesulfonamido)propylcarbamoyl]-6-oxoquinolizin-2-yl]oxypentylcarbamoylboron Traditional Name: 5-[8-[2-(benzenesulfonamido)propylcarbamoyl]-6-keto-quinolizin-2-yl]oxypentylcarbamoylboron Formula: C25H29BN4O6S MolecularWeight: 524.39696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NCCCCCOC1=CC2=CC(=CC(=O)N2C=C1)C(=O)NCC(C)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

[B]C(=O)NCCCCCOC1=CC2=CC(=CC(=O)N2C=C1)C(=O)NCC(C)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H29BN4O6S/c1-18(29-37(34,35)22-8-4-2-5-9-22)17-28-24(32)19-14-20-16-21(10-12-30(20)23(31)15-19)36-13-7-3-6-11-27-25(26)33/h2,4-5,8-10,12,14-16,18,29H,3,6-7,11,13,17H2,1H3,(H,27,33)(H,28,32)