5-(4-chloranylbutoxy)isoquinoline hydrochloride

Systemtic Name: 5-(4-chloranylbutoxy)isoquinoline hydrochloride Openeye Name: 5-(4-chlorobutoxy)isoquinoline hydrochloride CAS Name: 5-(4-chlorobutoxy)isoquinoline hydrochloride IUPAC Name: 5-(4-chlorobutoxy)isoquinoline hydrochloride Traditional Name: 5-(4-chlorobutoxy)isoquinoline hydrochloride Formula: C13H15Cl2NO MolecularWeight: 272.1703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)OCCCCCl.Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)OCCCCCl.Cl

InChI

InChI=1S/C13H14ClNO.ClH/c14-7-1-2-9-16-13-5-3-4-11-10-15-8-6-12(11)13;/h3-6,8,10H,1-2,7,9H2;1H