4-[(6-chloranylpyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one

Systemtic Name: 4-[(6-chloranylpyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one Openeye Name: 4-[(6-chloro-3-pyridyl)methyl]-1-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one CAS Name: 4-[(6-chloro-3-pyridinyl)methyl]-1-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one IUPAC Name: 4-[(6-chloropyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one Traditional Name: 4-[(6-chloro-3-pyridyl)methyl]-1-m-anisyl-1,4-diazepan-5-one Formula: C19H22ClN3O2 MolecularWeight: 359.84988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCC(=O)N(CC2)CC3=CN=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCC(=O)N(CC2)CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O2/c1-25-17-4-2-3-15(11-17)13-22-8-7-19(24)23(10-9-22)14-16-5-6-18(20)21-12-16/h2-6,11-12H,7-10,13-14H2,1H3