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

Systemtic Name: [3-[(4-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-2-oxidanyl-propyl]-dipropyl-azanium Openeye Name: [2-hydroxy-3-[4-methoxy-N-(p-tolylsulfonyl)anilino]propyl]-dipropyl-ammonium CAS Name: [2-hydroxy-3-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)propyl]-dipropylammonium IUPAC Name: [2-hydroxy-3-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)propyl]-dipropylazanium Traditional Name: [2-hydroxy-3-(4-methoxy-N-tosyl-anilino)propyl]-dipropyl-ammonium Formula: C23H35N2O4S+ MolecularWeight: 435.6

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O4S/c1-5-15-24(16-6-2)17-21(26)18-25(20-9-11-22(29-4)12-10-20)30(27,28)23-13-7-19(3)8-14-23/h7-14,21,26H,5-6,15-18H2,1-4H3/p+1