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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30ClN3O2/c1-14(2)11-19(25)22-16-5-6-18(17(21)13-16)23-7-9-24(10-8-23)20(26)12-15(3)4/h5-6,13-15H,7-12H2,1-4H3,(H,22,25)