2-(3-chloranyl-4-oxidanyl-phenyl)-1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(3-chloranyl-4-oxidanyl-phenyl)-1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(3-chloro-4-hydroxy-phenyl)-1-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]ethanone CAS Name: 2-(3-chloro-4-hydroxyphenyl)-1-[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(3-chloro-4-hydroxyphenyl)-1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 2-(3-chloro-4-hydroxy-phenyl)-1-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]ethanone Formula: C20H24ClN3O2 MolecularWeight: 373.87646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)CC3=CC(=C(C=C3)O)Cl

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)CC3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C20H24ClN3O2/c1-15-4-2-5-17(22-15)14-23-8-3-9-24(11-10-23)20(26)13-16-6-7-19(25)18(21)12-16/h2,4-7,12,25H,3,8-11,13-14H2,1H3