N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]pentanamide

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]pentanamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]pentanamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]pentanamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]pentanamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]valeramide Formula: C20H30ClN3O2 MolecularWeight: 379.9241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30ClN3O2/c1-4-5-6-19(25)22-16-7-8-18(17(21)14-16)23-9-11-24(12-10-23)20(26)13-15(2)3/h7-8,14-15H,4-6,9-13H2,1-3H3,(H,22,25)