5-[6-oxidanylidene-7-[[3-oxidanyl-3-oxidanylidene-2-(phenylsulfonylamino)propyl]carbamoyl]quinolizin-3-yl]oxypentylazanium

Systemtic Name: 5-[6-oxidanylidene-7-[[3-oxidanyl-3-oxidanylidene-2-(phenylsulfonylamino)propyl]carbamoyl]quinolizin-3-yl]oxypentylazanium Openeye Name: 5-[7-[[2-(benzenesulfonamido)-3-hydroxy-3-oxo-propyl]carbamoyl]-6-oxo-quinolizin-3-yl]oxypentylammonium CAS Name: 5-[[7-[[[2-(benzenesulfonamido)-3-hydroxy-3-oxopropyl]amino]-oxomethyl]-6-oxo-3-quinolizinyl]oxy]pentylammonium IUPAC Name: 5-[7-[[2-(benzenesulfonamido)-3-hydroxy-3-oxopropyl]carbamoyl]-6-oxoquinolizin-3-yl]oxypentylazanium Traditional Name: 5-[7-[[2-(benzenesulfonamido)-3-hydroxy-3-keto-propyl]carbamoyl]-6-keto-quinolizin-3-yl]oxypentylammonium Formula: C24H29N4O7S+ MolecularWeight: 517.57466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC(CNC(=O)C2=CC=C3C=CC(=CN3C2=O)OCCCCC[NH3+])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC(CNC(=O)C2=CC=C3C=CC(=CN3C2=O)OCCCCC[NH3+])C(=O)O

InChI

InChI=1S/C24H28N4O7S/c25-13-5-2-6-14-35-18-11-9-17-10-12-20(23(30)28(17)16-18)22(29)26-15-21(24(31)32)27-36(33,34)19-7-3-1-4-8-19/h1,3-4,7-12,16,21,27H,2,5-6,13-15,25H2,(H,26,29)(H,31,32)/p+1