N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-4-hexyl-benzamide

Systemtic Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-4-hexyl-benzamide Openeye Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-4-hexyl-benzamide CAS Name: N-[4-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]phenyl]-4-hexylbenzamide IUPAC Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-4-hexylbenzamide Traditional Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazino]phenyl]-4-hexyl-benzamide Formula: C29H41N3O2 MolecularWeight: 463.65474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC(C)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC(C)(C)C

InChI

InChI=1S/C29H41N3O2/c1-5-6-7-8-9-23-10-12-24(13-11-23)28(34)30-25-14-16-26(17-15-25)31-18-20-32(21-19-31)27(33)22-29(2,3)4/h10-17H,5-9,18-22H2,1-4H3,(H,30,34)