4-[2-oxidanylidene-2-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzenecarbonitrile hydrochloride

Systemtic Name: 4-[2-oxidanylidene-2-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[2-oxo-2-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzonitrile hydrochloride CAS Name: 4-[2-oxo-2-[1-(1-pyrrolidinylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzonitrile hydrochloride IUPAC Name: 4-[2-oxo-2-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzonitrile hydrochloride Traditional Name: 4-[2-keto-2-[1-(pyrrolidinomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzonitrile hydrochloride Formula: C23H26ClN3O MolecularWeight: 395.92504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2C3=CC=CC=C3CCN2C(=O)CC4=CC=C(C=C4)C#N.Cl

Isomeric SMILES

C1CCN(C1)CC2C3=CC=CC=C3CCN2C(=O)CC4=CC=C(C=C4)C#N.Cl

InChI

InChI=1S/C23H25N3O.ClH/c24-16-19-9-7-18(8-10-19)15-23(27)26-14-11-20-5-1-2-6-21(20)22(26)17-25-12-3-4-13-25;/h1-2,5-10,22H,3-4,11-15,17H2;1H