2-(4-methoxyphenyl)-N-[6-[4-(2-phenylethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[6-[4-(2-phenylethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide Openeye Name: 2-(4-methoxyphenyl)-N-[6-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]-3-pyridyl]acetamide CAS Name: 2-(4-methoxyphenyl)-N-[6-[4-(1-oxo-2-phenylethyl)-1,4-diazepan-1-yl]-3-pyridinyl]acetamide IUPAC Name: 2-(4-methoxyphenyl)-N-[6-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]pyridin-3-yl]acetamide Traditional Name: 2-(4-methoxyphenyl)-N-[6-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]-3-pyridyl]acetamide Formula: C27H30N4O3 MolecularWeight: 458.5521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H30N4O3/c1-34-24-11-8-22(9-12-24)18-26(32)29-23-10-13-25(28-20-23)30-14-5-15-31(17-16-30)27(33)19-21-6-3-2-4-7-21/h2-4,6-13,20H,5,14-19H2,1H3,(H,29,32)