5-[[3-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenoxy]methyl]-1,2-oxazinane-2-carboximidamide

Systemtic Name: 5-[[3-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenoxy]methyl]-1,2-oxazinane-2-carboximidamide Openeye Name: 5-[[3-chloro-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]methyl]oxazinane-2-carboxamidine CAS Name: 5-[[3-chloro-5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenoxy]methyl]-2-oxazinanecarboximidamide IUPAC Name: 5-[[3-chloro-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]methyl]oxazinane-2-carboximidamide Traditional Name: 5-[[3-chloro-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]methyl]oxazinane-2-carboxamidine Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(OCC1COC2=CC(=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)Cl)C(=N)N

Isomeric SMILES

C1CN(OCC1COC2=CC(=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)Cl)C(=N)N

InChI

InChI=1S/C22H25ClN4O3/c23-19-9-18(21(28)26-7-6-16-3-1-2-4-17(16)12-26)10-20(11-19)29-13-15-5-8-27(22(24)25)30-14-15/h1-4,9-11,15H,5-8,12-14H2,(H3,24,25)