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

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]propanamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]propanamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]propanamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]propanamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]propionamide Formula: C18H26ClN3O2 MolecularWeight: 351.87094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26ClN3O2/c1-4-17(23)20-14-5-6-16(15(19)12-14)21-7-9-22(10-8-21)18(24)11-13(2)3/h5-6,12-13H,4,7-11H2,1-3H3,(H,20,23)