N-[5-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]heptanamide

Systemtic Name: N-[5-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]heptanamide Openeye Name: N-[5-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]heptanamide CAS Name: N-[5-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]heptanamide IUPAC Name: N-[5-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]heptanamide Traditional Name: N-[5-chloro-2-(4-isobutyrylpiperazino)phenyl]enanthamide Formula: C21H32ClN3O2 MolecularWeight: 393.95068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32ClN3O2/c1-4-5-6-7-8-20(26)23-18-15-17(22)9-10-19(18)24-11-13-25(14-12-24)21(27)16(2)3/h9-10,15-16H,4-8,11-14H2,1-3H3,(H,23,26)