diethyl-[(2R)-3-[(3-methylphenyl)-(phenylsulfonyl)amino]-2-oxidanyl-propyl]azanium

Systemtic Name: diethyl-[(2R)-3-[(3-methylphenyl)-(phenylsulfonyl)amino]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-[N-(benzenesulfonyl)-3-methyl-anilino]-2-hydroxy-propyl]-diethyl-ammonium CAS Name: [(2R)-3-[N-(benzenesulfonyl)-3-methylanilino]-2-hydroxypropyl]-diethylammonium IUPAC Name: [(2R)-3-[N-(benzenesulfonyl)-3-methylanilino]-2-hydroxypropyl]-diethylazanium Traditional Name: [(2R)-3-(N-besyl-3-methyl-anilino)-2-hydroxy-propyl]-diethyl-ammonium Formula: C20H29N2O3S+ MolecularWeight: 377.52086

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(CN(C1=CC=CC(=C1)C)S(=O)(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC[NH+](CC)C[C@H](CN(C1=CC=CC(=C1)C)S(=O)(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C20H28N2O3S/c1-4-21(5-2)15-19(23)16-22(18-11-9-10-17(3)14-18)26(24,25)20-12-7-6-8-13-20/h6-14,19,23H,4-5,15-16H2,1-3H3/p+1/t19-/m1/s1