3-chloranyl-2,2-dimethyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 3-chloranyl-2,2-dimethyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]propanamide Openeye Name: 3-chloro-2,2-dimethyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]propanamide CAS Name: 3-chloro-2,2-dimethyl-N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]propanamide IUPAC Name: 3-chloro-2,2-dimethyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]propanamide Traditional Name: N-[4-(4-caprylylpiperazino)phenyl]-3-chloro-2,2-dimethyl-propionamide Formula: C23H36ClN3O2 MolecularWeight: 422.00384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)(C)CCl

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)(C)CCl

InChI

InChI=1S/C23H36ClN3O2/c1-4-5-6-7-8-9-21(28)27-16-14-26(15-17-27)20-12-10-19(11-13-20)25-22(29)23(2,3)18-24/h10-13H,4-9,14-18H2,1-3H3,(H,25,29)