4-(1,1-dipropylpyrrolidin-1-ium-2-yl)benzene-1,2-diol hydroxide

Systemtic Name: 4-(1,1-dipropylpyrrolidin-1-ium-2-yl)benzene-1,2-diol hydroxide Openeye Name: 4-(1,1-dipropylpyrrolidin-1-ium-2-yl)benzene-1,2-diol hydroxide CAS Name: 4-(1,1-dipropyl-2-pyrrolidin-1-iumyl)benzene-1,2-diol hydroxide IUPAC Name: 4-(1,1-dipropylpyrrolidin-1-ium-2-yl)benzene-1,2-diol hydroxide Traditional Name: 4-(1,1-dipropylpyrrolidin-1-ium-2-yl)pyrocatechol hydroxide Formula: C16H27NO3 MolecularWeight: 281.39048

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(CCCC1C2=CC(=C(C=C2)O)O)CCC.[OH-]

Isomeric SMILES

CCC[N+]1(CCCC1C2=CC(=C(C=C2)O)O)CCC.[OH-]

InChI

InChI=1S/C16H25NO2.H2O/c1-3-9-17(10-4-2)11-5-6-14(17)13-7-8-15(18)16(19)12-13;/h7-8,12,14H,3-6,9-11H2,1-2H3,(H-,18,19);1H2