[2-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)-propyl-azanium

Systemtic Name: [2-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)-propyl-azanium Openeye Name: benzyl-[2-[2-methoxy-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-propyl-ammonium CAS Name: [2-[2-methoxy-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-(phenylmethyl)-propylammonium IUPAC Name: benzyl-[2-(2-methoxy-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-propylazanium Traditional Name: benzyl-[2-keto-2-(2-methoxy-5-piperidinosulfonyl-anilino)ethyl]-propyl-ammonium Formula: C24H34N3O4S+ MolecularWeight: 460.60946

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC

Isomeric SMILES

CCC[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC

InChI

InChI=1S/C24H33N3O4S/c1-3-14-26(18-20-10-6-4-7-11-20)19-24(28)25-22-17-21(12-13-23(22)31-2)32(29,30)27-15-8-5-9-16-27/h4,6-7,10-13,17H,3,5,8-9,14-16,18-19H2,1-2H3,(H,25,28)/p+1