N-[[2-(3-chloranyl-2-oxidanyl-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide

Systemtic Name: N-[[2-(3-chloranyl-2-oxidanyl-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide Openeye Name: N-[[2-(3-chloro-2-hydroxy-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide CAS Name: N-[[2-(3-chloro-2-hydroxypropyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide IUPAC Name: N-[[2-(3-chloro-2-hydroxypropyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide Traditional Name: N-[[2-(3-chloro-2-hydroxy-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide Formula: C20H23ClN2O2 MolecularWeight: 358.86182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CNC(=O)C3=CC=CC=C3)CC(CCl)O

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CNC(=O)C3=CC=CC=C3)CC(CCl)O

InChI

InChI=1S/C20H23ClN2O2/c21-12-17(24)14-23-11-10-15-6-4-5-9-18(15)19(23)13-22-20(25)16-7-2-1-3-8-16/h1-9,17,19,24H,10-14H2,(H,22,25)