2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-ol hydrate hydrobromide

Systemtic Name: 2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-ol hydrate hydrobromide Openeye Name: 2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-5-ol hydrate hydrobromide CAS Name: 2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-ol hydrate hydrobromide IUPAC Name: 2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-ol hydrate hydrobromide Traditional Name: 2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-5-ol hydrate hydrobromide Formula: C14H18BrN3O2 MolecularWeight: 340.21562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=CC=C2)O)NC3=CC=NC=C3.O.Br

Isomeric SMILES

C1CN(CC2=C1C(=CC=C2)O)NC3=CC=NC=C3.O.Br

InChI

InChI=1S/C14H15N3O.BrH.H2O/c18-14-3-1-2-11-10-17(9-6-13(11)14)16-12-4-7-15-8-5-12;;/h1-5,7-8,18H,6,9-10H2,(H,15,16);1H;1H2