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

Systemtic Name: ethyl-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]ammonium CAS Name: ethyl-[2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: benzyl-ethyl-[2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl]ammonium Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S/c1-3-25(17-20-10-6-4-7-11-20)18-23(27)24-22-16-21(13-12-19(22)2)30(28,29)26-14-8-5-9-15-26/h4,6-7,10-13,16H,3,5,8-9,14-15,17-18H2,1-2H3,(H,24,27)/p+1