6-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one

Systemtic Name: 6-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one Openeye Name: 6-[[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]oxy]-2H-isoquinolin-1-one CAS Name: 6-[[1-(1H-pyrrol-2-ylmethyl)-4-piperidinyl]oxy]-2H-isoquinolin-1-one IUPAC Name: 6-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one Traditional Name: 6-[[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]oxy]isocarbostyril Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC3=C(C=C2)C(=O)NC=C3)CC4=CC=CN4

Isomeric SMILES

C1CN(CCC1OC2=CC3=C(C=C2)C(=O)NC=C3)CC4=CC=CN4

InChI

InChI=1S/C19H21N3O2/c23-19-18-4-3-17(12-14(18)5-9-21-19)24-16-6-10-22(11-7-16)13-15-2-1-8-20-15/h1-5,8-9,12,16,20H,6-7,10-11,13H2,(H,21,23)