(5-chloranyl-2-oxidanyl-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Openeye Name: (5-chloro-2-hydroxy-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone CAS Name: (5-chloro-2-hydroxyphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone IUPAC Name: (5-chloro-2-hydroxyphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Traditional Name: (5-chloro-2-hydroxy-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Formula: C13H17ClN2O2 MolecularWeight: 268.73928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CN1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C13H17ClN2O2/c1-15-5-2-6-16(8-7-15)13(18)11-9-10(14)3-4-12(11)17/h3-4,9,17H,2,5-8H2,1H3