N-[3-chloranyl-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]heptanamide

Systemtic Name: N-[3-chloranyl-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]heptanamide Openeye Name: N-[3-chloro-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]heptanamide CAS Name: N-[3-chloro-4-[4-(2,2-dimethyl-1-oxopropyl)-1-piperazinyl]phenyl]heptanamide IUPAC Name: N-[3-chloro-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]heptanamide Traditional Name: N-[3-chloro-4-(4-pivaloylpiperazino)phenyl]enanthamide Formula: C22H34ClN3O2 MolecularWeight: 407.97726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C(C)(C)C)Cl

Isomeric SMILES

CCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C(C)(C)C)Cl

InChI

InChI=1S/C22H34ClN3O2/c1-5-6-7-8-9-20(27)24-17-10-11-19(18(23)16-17)25-12-14-26(15-13-25)21(28)22(2,3)4/h10-11,16H,5-9,12-15H2,1-4H3,(H,24,27)