methanesulfonate; [4-(5-phenylpentoxy)phenyl]azanium

Systemtic Name: methanesulfonate; [4-(5-phenylpentoxy)phenyl]azanium Openeye Name: methanesulfonate; [4-(5-phenylpentoxy)phenyl]ammonium CAS Name: methanesulfonate; [4-(5-phenylpentoxy)phenyl]ammonium IUPAC Name: methanesulfonate; [4-(5-phenylpentoxy)phenyl]azanium Traditional Name: [4-(5-phenylpentoxy)phenyl]ammonium mesylate Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC=C(C=C1)CCCCCOC2=CC=C(C=C2)[NH3+]

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC=C(C=C1)CCCCCOC2=CC=C(C=C2)[NH3+]

InChI

InChI=1S/C17H21NO.CH4O3S/c18-16-10-12-17(13-11-16)19-14-6-2-5-9-15-7-3-1-4-8-15;1-5(2,3)4/h1,3-4,7-8,10-13H,2,5-6,9,14,18H2;1H3,(H,2,3,4)