6-[(3S)-1-(2-phenoxyethyl)piperidin-3-yl]oxy-2H-isoquinolin-1-one

Systemtic Name: 6-[(3S)-1-(2-phenoxyethyl)piperidin-3-yl]oxy-2H-isoquinolin-1-one Openeye Name: 6-[[(3S)-1-(2-phenoxyethyl)-3-piperidyl]oxy]-2H-isoquinolin-1-one CAS Name: 6-[[(3S)-1-(2-phenoxyethyl)-3-piperidinyl]oxy]-2H-isoquinolin-1-one IUPAC Name: 6-[(3S)-1-(2-phenoxyethyl)piperidin-3-yl]oxy-2H-isoquinolin-1-one Traditional Name: 6-[[(3S)-1-(2-phenoxyethyl)-3-piperidyl]oxy]isocarbostyril Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOC2=CC=CC=C2)OC3=CC4=C(C=C3)C(=O)NC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)CCOC2=CC=CC=C2)OC3=CC4=C(C=C3)C(=O)NC=C4

InChI

InChI=1S/C22H24N2O3/c25-22-21-9-8-19(15-17(21)10-11-23-22)27-20-7-4-12-24(16-20)13-14-26-18-5-2-1-3-6-18/h1-3,5-6,8-11,15,20H,4,7,12-14,16H2,(H,23,25)/t20-/m0/s1