2-[1-[3-(2-methylphenoxy)-2-oxidanyl-propyl]piperidin-4-yl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[1-[3-(2-methylphenoxy)-2-oxidanyl-propyl]piperidin-4-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[1-[2-hydroxy-3-(2-methylphenoxy)propyl]-4-piperidyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[1-[2-hydroxy-3-(2-methylphenoxy)propyl]-4-piperidinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[1-[2-hydroxy-3-(2-methylphenoxy)propyl]piperidin-4-yl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[1-[2-hydroxy-3-(2-methylphenoxy)propyl]-4-piperidyl]-3,4-dihydroisocarbostyril Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CN2CCC(CC2)N3CCC4=CC=CC=C4C3=O)O

Isomeric SMILES

CC1=CC=CC=C1OCC(CN2CCC(CC2)N3CCC4=CC=CC=C4C3=O)O

InChI

InChI=1S/C24H30N2O3/c1-18-6-2-5-9-23(18)29-17-21(27)16-25-13-11-20(12-14-25)26-15-10-19-7-3-4-8-22(19)24(26)28/h2-9,20-21,27H,10-17H2,1H3