(2S)-2-chloranyl-N-[4-(4-hexanoylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: (2S)-2-chloranyl-N-[4-(4-hexanoylpiperazin-1-yl)phenyl]propanamide Openeye Name: (2S)-2-chloro-N-[4-(4-hexanoylpiperazin-1-yl)phenyl]propanamide CAS Name: (2S)-2-chloro-N-[4-[4-(1-oxohexyl)-1-piperazinyl]phenyl]propanamide IUPAC Name: (2S)-2-chloro-N-[4-(4-hexanoylpiperazin-1-yl)phenyl]propanamide Traditional Name: (2S)-N-[4-(4-caproylpiperazino)phenyl]-2-chloro-propionamide Formula: C19H28ClN3O2 MolecularWeight: 365.89752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)Cl

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)[C@H](C)Cl

InChI

InChI=1S/C19H28ClN3O2/c1-3-4-5-6-18(24)23-13-11-22(12-14-23)17-9-7-16(8-10-17)21-19(25)15(2)20/h7-10,15H,3-6,11-14H2,1-2H3,(H,21,25)/t15-/m0/s1