ethyl-[2-oxidanylidene-2-[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]ethyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: ethyl-[2-oxidanylidene-2-[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]ethyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: ethyl-[2-[2-isopropoxy-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-[2-(isopropylamino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[2-oxo-2-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyanilino]ethyl]-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: ethyl-[2-oxo-2-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyanilino)ethyl]-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: ethyl-[2-(2-isopropoxy-5-piperidinosulfonyl-anilino)-2-keto-ethyl]-[2-(isopropylamino)-2-keto-ethyl]ammonium Formula: C23H39N4O5S+ MolecularWeight: 483.64456

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)OC(C)C)CC(=O)NC(C)C

Isomeric SMILES

CC[NH+](CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)OC(C)C)CC(=O)NC(C)C

InChI

InChI=1S/C23H38N4O5S/c1-6-26(15-22(28)24-17(2)3)16-23(29)25-20-14-19(10-11-21(20)32-18(4)5)33(30,31)27-12-8-7-9-13-27/h10-11,14,17-18H,6-9,12-13,15-16H2,1-5H3,(H,24,28)(H,25,29)/p+1