1-[5-(4-methoxy-3,5-dimethyl-phenyl)pyridin-2-yl]-1,4-diazepane

Systemtic Name: 1-[5-(4-methoxy-3,5-dimethyl-phenyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1-[5-(4-methoxy-3,5-dimethyl-phenyl)-2-pyridyl]-1,4-diazepane CAS Name: 1-[5-(4-methoxy-3,5-dimethylphenyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1-[5-(4-methoxy-3,5-dimethylphenyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1-[5-(4-methoxy-3,5-dimethyl-phenyl)-2-pyridyl]-1,4-diazepane Formula: C19H25N3O MolecularWeight: 311.4213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)C2=CN=C(C=C2)N3CCCNCC3

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)C2=CN=C(C=C2)N3CCCNCC3

InChI

InChI=1S/C19H25N3O/c1-14-11-17(12-15(2)19(14)23-3)16-5-6-18(21-13-16)22-9-4-7-20-8-10-22/h5-6,11-13,20H,4,7-10H2,1-3H3