3-[(5-methoxy-2-oxidanyl-phenyl)methylamino]azepan-2-one

Systemtic Name: 3-[(5-methoxy-2-oxidanyl-phenyl)methylamino]azepan-2-one Openeye Name: 3-[(2-hydroxy-5-methoxy-phenyl)methylamino]azepan-2-one CAS Name: 3-[(2-hydroxy-5-methoxyphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(2-hydroxy-5-methoxyphenyl)methylamino]azepan-2-one Traditional Name: 3-[(2-hydroxy-5-methoxy-benzyl)amino]azepan-2-one Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)CNC2CCCCNC2=O

Isomeric SMILES

COC1=CC(=C(C=C1)O)CNC2CCCCNC2=O

InChI

InChI=1S/C14H20N2O3/c1-19-11-5-6-13(17)10(8-11)9-16-12-4-2-3-7-15-14(12)18/h5-6,8,12,16-17H,2-4,7,9H2,1H3,(H,15,18)