3,4-dimethyl-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 3,4-dimethyl-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3,4-dimethyl-N-[4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3,4-dimethyl-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: N-[4-(4-isovalerylpiperazino)phenyl]-3,4-dimethyl-benzamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC(C)C)C

InChI

InChI=1S/C24H31N3O2/c1-17(2)15-23(28)27-13-11-26(12-14-27)22-9-7-21(8-10-22)25-24(29)20-6-5-18(3)19(4)16-20/h5-10,16-17H,11-15H2,1-4H3,(H,25,29)