dibutyl-[(2R)-3-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-2-oxidanyl-propyl]azanium

Systemtic Name: dibutyl-[(2R)-3-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-2-oxidanyl-propyl]azanium Openeye Name: dibutyl-[(2R)-2-hydroxy-3-[2-methoxy-N-(p-tolylsulfonyl)anilino]propyl]ammonium CAS Name: dibutyl-[(2R)-2-hydroxy-3-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)propyl]ammonium IUPAC Name: dibutyl-[(2R)-2-hydroxy-3-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)propyl]azanium Traditional Name: dibutyl-[(2R)-2-hydroxy-3-(2-methoxy-N-tosyl-anilino)propyl]ammonium Formula: C25H39N2O4S+ MolecularWeight: 463.65316

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC(CN(C1=CC=CC=C1OC)S(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

CCCC[NH+](CCCC)C[C@H](CN(C1=CC=CC=C1OC)S(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C25H38N2O4S/c1-5-7-17-26(18-8-6-2)19-22(28)20-27(24-11-9-10-12-25(24)31-4)32(29,30)23-15-13-21(3)14-16-23/h9-16,22,28H,5-8,17-20H2,1-4H3/p+1/t22-/m1/s1