N-[4-(azepan-1-yl)phenyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(4-isobutyrylpiperazino)acetamide Formula: C22H34N4O2 MolecularWeight: 386.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C22H34N4O2/c1-18(2)22(28)26-15-13-24(14-16-26)17-21(27)23-19-7-9-20(10-8-19)25-11-5-3-4-6-12-25/h7-10,18H,3-6,11-17H2,1-2H3,(H,23,27)