(4-hydroxyphenyl)sulfonyl-(2-methylpropyl)-(phenylmethyl)-propyl-azanium

Systemtic Name: (4-hydroxyphenyl)sulfonyl-(2-methylpropyl)-(phenylmethyl)-propyl-azanium Openeye Name: benzyl-(4-hydroxyphenyl)sulfonyl-isobutyl-propyl-ammonium CAS Name: (4-hydroxyphenyl)sulfonyl-(2-methylpropyl)-(phenylmethyl)-propylammonium IUPAC Name: benzyl-(4-hydroxyphenyl)sulfonyl-(2-methylpropyl)-propylazanium Traditional Name: benzyl-(4-hydroxyphenyl)sulfonyl-isobutyl-propyl-ammonium Formula: C20H28NO3S+ MolecularWeight: 362.50622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO3S/c1-4-14-21(15-17(2)3,16-18-8-6-5-7-9-18)25(23,24)20-12-10-19(22)11-13-20/h5-13,17H,4,14-16H2,1-3H3/p+1