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

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]-2,2-dimethyl-propionamide Formula: C20H30ClN3O2 MolecularWeight: 379.9241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30ClN3O2/c1-14(2)12-18(25)24-10-8-23(9-11-24)17-7-6-15(13-16(17)21)22-19(26)20(3,4)5/h6-7,13-14H,8-12H2,1-5H3,(H,22,26)