N,N-dimethyl-2-[4-[4-(pyridin-3-ylmethoxy)phenyl]carbonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-[4-(pyridin-3-ylmethoxy)phenyl]carbonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-[4-(3-pyridylmethoxy)benzoyl]-1,4-diazepan-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[oxo-[4-(3-pyridinylmethoxy)phenyl]methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N,N-dimethyl-2-[4-[4-(pyridin-3-ylmethoxy)benzoyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-[4-(3-pyridylmethoxy)benzoyl]-1,4-diazepan-1-yl]acetamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC=C(C=C2)OCC3=CN=CC=C3

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC=C(C=C2)OCC3=CN=CC=C3

InChI

InChI=1S/C22H28N4O3/c1-24(2)21(27)16-25-11-4-12-26(14-13-25)22(28)19-6-8-20(9-7-19)29-17-18-5-3-10-23-15-18/h3,5-10,15H,4,11-14,16-17H2,1-2H3