3-(aminomethyl)pyrimido[2,1-a]isoquinolin-4-one dihydrochloride

Systemtic Name: 3-(aminomethyl)pyrimido[2,1-a]isoquinolin-4-one dihydrochloride Openeye Name: 3-(aminomethyl)pyrimido[2,1-a]isoquinolin-4-one dihydrochloride CAS Name: 3-(aminomethyl)-4-pyrimido[2,1-a]isoquinolinone dihydrochloride IUPAC Name: 3-(aminomethyl)pyrimido[2,1-a]isoquinolin-4-one dihydrochloride Traditional Name: 3-(aminomethyl)pyrimid[2,1-a]isoquinolin-4-one dihydrochloride Formula: C13H13Cl2N3O MolecularWeight: 298.16782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN3C2=NC=C(C3=O)CN.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CN3C2=NC=C(C3=O)CN.Cl.Cl

InChI

InChI=1S/C13H11N3O.2ClH/c14-7-10-8-15-12-11-4-2-1-3-9(11)5-6-16(12)13(10)17;;/h1-6,8H,7,14H2;2*1H