N'-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]pyrrolidine-1-carboximidamide hydrochloride

Systemtic Name: N'-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]pyrrolidine-1-carboximidamide hydrochloride Openeye Name: N'-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]pyrrolidine-1-carboxamidine hydrochloride CAS Name: N'-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-1-pyrrolidinecarboximidamide hydrochloride IUPAC Name: N'-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]pyrrolidine-1-carboximidamide hydrochloride Traditional Name: N'-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]pyrrolidine-1-carboxamidine hydrochloride Formula: C21H25ClN4O MolecularWeight: 384.9024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=NC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)N.Cl

Isomeric SMILES

C1CCN(C1)C(=NC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)N.Cl

InChI

InChI=1S/C21H24N4O.ClH/c22-21(24-11-3-4-12-24)23-19-9-5-8-17(14-19)20(26)25-13-10-16-6-1-2-7-18(16)15-25;/h1-2,5-9,14H,3-4,10-13,15H2,(H2,22,23);1H