[3-[(3-methylphenyl)-(phenylsulfonyl)amino]-2-oxidanyl-propyl]-bis(2-methylpropyl)azanium

Systemtic Name: [3-[(3-methylphenyl)-(phenylsulfonyl)amino]-2-oxidanyl-propyl]-bis(2-methylpropyl)azanium Openeye Name: [3-[N-(benzenesulfonyl)-3-methyl-anilino]-2-hydroxy-propyl]-diisobutyl-ammonium CAS Name: [3-[N-(benzenesulfonyl)-3-methylanilino]-2-hydroxypropyl]-bis(2-methylpropyl)ammonium IUPAC Name: [3-[N-(benzenesulfonyl)-3-methylanilino]-2-hydroxypropyl]-bis(2-methylpropyl)azanium Traditional Name: [3-(N-besyl-3-methyl-anilino)-2-hydroxy-propyl]-diisobutyl-ammonium Formula: C24H37N2O3S+ MolecularWeight: 433.62718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H36N2O3S/c1-19(2)15-25(16-20(3)4)17-23(27)18-26(22-11-9-10-21(5)14-22)30(28,29)24-12-7-6-8-13-24/h6-14,19-20,23,27H,15-18H2,1-5H3/p+1