ethyl-[2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[2-(3-morpholinosulfonylanilino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[2-[3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: benzyl-ethyl-[2-keto-2-(3-morpholinosulfonylanilino)ethyl]ammonium Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O4S/c1-2-23(16-18-7-4-3-5-8-18)17-21(25)22-19-9-6-10-20(15-19)29(26,27)24-11-13-28-14-12-24/h3-10,15H,2,11-14,16-17H2,1H3,(H,22,25)/p+1