2-[4-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]-1,4-diazepan-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]-1,4-diazepan-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[2-(4-chlorophenoxy)-2-methyl-propanoyl]-1,4-diazepan-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]-1,4-diazepan-1-yl]-N-phenylacetamide IUPAC Name: 2-[4-[2-(4-chlorophenoxy)-2-methylpropanoyl]-1,4-diazepan-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[2-(4-chlorophenoxy)-2-methyl-propanoyl]-1,4-diazepan-1-yl]-N-phenyl-acetamide Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCCN(CC1)CC(=O)NC2=CC=CC=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)N1CCCN(CC1)CC(=O)NC2=CC=CC=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O3/c1-23(2,30-20-11-9-18(24)10-12-20)22(29)27-14-6-13-26(15-16-27)17-21(28)25-19-7-4-3-5-8-19/h3-5,7-12H,6,13-17H2,1-2H3,(H,25,28)