3-[6-oxidanylidene-8-[2-(phenylsulfonylamino)propylcarbamoyl]quinolizin-2-yl]oxypropylcarbamoylboron

Systemtic Name: 3-[6-oxidanylidene-8-[2-(phenylsulfonylamino)propylcarbamoyl]quinolizin-2-yl]oxypropylcarbamoylboron Openeye Name: 3-[8-[2-(benzenesulfonamido)propylcarbamoyl]-6-oxo-quinolizin-2-yl]oxypropylcarbamoylboron CAS Name: [[3-[[8-[[2-(benzenesulfonamido)propylamino]-oxomethyl]-6-oxo-2-quinolizinyl]oxy]propylamino]-oxomethyl]boron IUPAC Name: 3-[8-[2-(benzenesulfonamido)propylcarbamoyl]-6-oxoquinolizin-2-yl]oxypropylcarbamoylboron Traditional Name: 3-[8-[2-(benzenesulfonamido)propylcarbamoyl]-6-keto-quinolizin-2-yl]oxypropylcarbamoylboron Formula: C23H25BN4O6S MolecularWeight: 496.3438

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NCCCOC1=CC2=CC(=CC(=O)N2C=C1)C(=O)NCC(C)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

[B]C(=O)NCCCOC1=CC2=CC(=CC(=O)N2C=C1)C(=O)NCC(C)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25BN4O6S/c1-16(27-35(32,33)20-6-3-2-4-7-20)15-26-22(30)17-12-18-14-19(8-10-28(18)21(29)13-17)34-11-5-9-25-23(24)31/h2-4,6-8,10,12-14,16,27H,5,9,11,15H2,1H3,(H,25,31)(H,26,30)