[1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-propyl-azanium; propyl sulfate

Systemtic Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-propyl-azanium; propyl sulfate Openeye Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-propyl-ammonium; propyl sulfate CAS Name: [1-(4-aminophenyl)-3-pyrrolidinyl]-dimethyl-propylammonium; propyl sulfate IUPAC Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-propylazanium; propyl sulfate Traditional Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-propyl-ammonium; propyl sulfate Formula: C18H33N3O4S MolecularWeight: 387.53732

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)C1CCN(C1)C2=CC=C(C=C2)N.CCCOS(=O)(=O)[O-]

Isomeric SMILES

CCC[N+](C)(C)C1CCN(C1)C2=CC=C(C=C2)N.CCCOS(=O)(=O)[O-]

InChI

InChI=1S/C15H26N3.C3H8O4S/c1-4-11-18(2,3)15-9-10-17(12-15)14-7-5-13(16)6-8-14;1-2-3-7-8(4,5)6/h5-8,15H,4,9-12,16H2,1-3H3;2-3H2,1H3,(H,4,5,6)/q+1;/p-1