1-[2-(3-chloranylphenoxy)propanoyl]-4-(2-methylpropyl)-1,4-diazepan-5-one

Systemtic Name: 1-[2-(3-chloranylphenoxy)propanoyl]-4-(2-methylpropyl)-1,4-diazepan-5-one Openeye Name: 1-[2-(3-chlorophenoxy)propanoyl]-4-isobutyl-1,4-diazepan-5-one CAS Name: 1-[2-(3-chlorophenoxy)-1-oxopropyl]-4-(2-methylpropyl)-1,4-diazepan-5-one IUPAC Name: 1-[2-(3-chlorophenoxy)propanoyl]-4-(2-methylpropyl)-1,4-diazepan-5-one Traditional Name: 1-[2-(3-chlorophenoxy)propanoyl]-4-isobutyl-1,4-diazepan-5-one Formula: C18H25ClN2O3 MolecularWeight: 352.8557

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CCC1=O)C(=O)C(C)OC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CN1CCN(CCC1=O)C(=O)C(C)OC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H25ClN2O3/c1-13(2)12-21-10-9-20(8-7-17(21)22)18(23)14(3)24-16-6-4-5-15(19)11-16/h4-6,11,13-14H,7-10,12H2,1-3H3