5-[[1-oxidanylidene-2-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinolin-6-yl]oxy]pyridine-2-carbonitrile

Systemtic Name: 5-[[1-oxidanylidene-2-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinolin-6-yl]oxy]pyridine-2-carbonitrile Openeye Name: 5-[[1-oxo-2-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinolin-6-yl]oxy]pyridine-2-carbonitrile CAS Name: 5-[[1-oxo-2-[2-(1-pyrrolidinyl)ethyl]-3,4-dihydroisoquinolin-6-yl]oxy]-2-pyridinecarbonitrile IUPAC Name: 5-[[1-oxo-2-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinolin-6-yl]oxy]pyridine-2-carbonitrile Traditional Name: 5-[[1-keto-2-(2-pyrrolidinoethyl)-3,4-dihydroisoquinolin-6-yl]oxy]picolinonitrile Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2CCC3=C(C2=O)C=CC(=C3)OC4=CN=C(C=C4)C#N

Isomeric SMILES

C1CCN(C1)CCN2CCC3=C(C2=O)C=CC(=C3)OC4=CN=C(C=C4)C#N

InChI

InChI=1S/C21H22N4O2/c22-14-17-3-4-19(15-23-17)27-18-5-6-20-16(13-18)7-10-25(21(20)26)12-11-24-8-1-2-9-24/h3-6,13,15H,1-2,7-12H2