5-[6-(1,4-diazepan-1-yl)pyridin-3-yl]-2,3-dimethoxy-phenol

Systemtic Name: 5-[6-(1,4-diazepan-1-yl)pyridin-3-yl]-2,3-dimethoxy-phenol Openeye Name: 5-[6-(1,4-diazepan-1-yl)-3-pyridyl]-2,3-dimethoxy-phenol CAS Name: 5-[6-(1,4-diazepan-1-yl)-3-pyridinyl]-2,3-dimethoxyphenol IUPAC Name: 5-[6-(1,4-diazepan-1-yl)pyridin-3-yl]-2,3-dimethoxyphenol Traditional Name: 5-[6-(1,4-diazepan-1-yl)-3-pyridyl]-2,3-dimethoxy-phenol Formula: C18H23N3O3 MolecularWeight: 329.39352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)O)C2=CN=C(C=C2)N3CCCNCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)O)C2=CN=C(C=C2)N3CCCNCC3

InChI

InChI=1S/C18H23N3O3/c1-23-16-11-14(10-15(22)18(16)24-2)13-4-5-17(20-12-13)21-8-3-6-19-7-9-21/h4-5,10-12,19,22H,3,6-9H2,1-2H3