3-quinolin-1-ium-1-ylpropan-1-ol perchlorate

Systemtic Name: 3-quinolin-1-ium-1-ylpropan-1-ol perchlorate Openeye Name: 3-quinolin-1-ium-1-ylpropan-1-ol perchlorate CAS Name: 3-(1-quinolin-1-iumyl)-1-propanol perchlorate IUPAC Name: 3-quinolin-1-ium-1-ylpropan-1-ol perchlorate Traditional Name: 3-quinolin-1-ium-1-ylpropan-1-ol perchlorate Formula: C12H14ClNO5 MolecularWeight: 287.69626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CCCO.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2CCCO.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H14NO.ClHO4/c14-10-4-9-13-8-3-6-11-5-1-2-7-12(11)13;2-1(3,4)5/h1-3,5-8,14H,4,9-10H2;(H,2,3,4,5)/q+1;/p-1