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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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