1-[5-chloranyl-3-[(4-methyl-1,4-diazepan-1-yl)methyl]-2-oxidanyl-phenyl]ethanone

Systemtic Name: 1-[5-chloranyl-3-[(4-methyl-1,4-diazepan-1-yl)methyl]-2-oxidanyl-phenyl]ethanone Openeye Name: 1-[5-chloro-2-hydroxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]ethanone CAS Name: 1-[5-chloro-2-hydroxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]ethanone IUPAC Name: 1-[5-chloro-2-hydroxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]ethanone Traditional Name: 1-[5-chloro-2-hydroxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]ethanone Formula: C15H21ClN2O2 MolecularWeight: 296.79244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1O)CN2CCCN(CC2)C)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1O)CN2CCCN(CC2)C)Cl

InChI

InChI=1S/C15H21ClN2O2/c1-11(19)14-9-13(16)8-12(15(14)20)10-18-5-3-4-17(2)6-7-18/h8-9,20H,3-7,10H2,1-2H3