dipentyl-(4-phenylbutyl)-propyl-azanium; methanesulfonate

Systemtic Name: dipentyl-(4-phenylbutyl)-propyl-azanium; methanesulfonate Openeye Name: dipentyl-(4-phenylbutyl)-propyl-ammonium; methanesulfonate CAS Name: dipentyl-(4-phenylbutyl)-propylammonium; methanesulfonate IUPAC Name: dipentyl-(4-phenylbutyl)-propylazanium; methanesulfonate Traditional Name: diamyl-(4-phenylbutyl)-propyl-ammonium mesylate Formula: C24H45NO3S MolecularWeight: 427.684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCC)(CCCCC)CCCCC1=CC=CC=C1.CS(=O)(=O)[O-]

Isomeric SMILES

CCCCC[N+](CCC)(CCCCC)CCCCC1=CC=CC=C1.CS(=O)(=O)[O-]

InChI

InChI=1S/C23H42N.CH4O3S/c1-4-7-13-20-24(19-6-3,21-14-8-5-2)22-15-12-18-23-16-10-9-11-17-23;1-5(2,3)4/h9-11,16-17H,4-8,12-15,18-22H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1