N-[(4-fluorophenyl)methyl]-3,3-dimethyl-N-[2-(4-nonanoylpiperazin-1-yl)ethyl]butanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3,3-dimethyl-N-[2-(4-nonanoylpiperazin-1-yl)ethyl]butanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3,3-dimethyl-N-[2-(4-nonanoylpiperazin-1-yl)ethyl]butanamide CAS Name: N-[(4-fluorophenyl)methyl]-3,3-dimethyl-N-[2-[4-(1-oxononyl)-1-piperazinyl]ethyl]butanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3,3-dimethyl-N-[2-(4-nonanoylpiperazin-1-yl)ethyl]butanamide Traditional Name: N-(4-fluorobenzyl)-3,3-dimethyl-N-[2-(4-pelargonylpiperazino)ethyl]butyramide Formula: C28H46FN3O2 MolecularWeight: 475.682143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)N1CCN(CC1)CCN(CC2=CC=C(C=C2)F)C(=O)CC(C)(C)C

Isomeric SMILES

CCCCCCCCC(=O)N1CCN(CC1)CCN(CC2=CC=C(C=C2)F)C(=O)CC(C)(C)C

InChI

InChI=1S/C28H46FN3O2/c1-5-6-7-8-9-10-11-26(33)31-19-16-30(17-20-31)18-21-32(27(34)22-28(2,3)4)23-24-12-14-25(29)15-13-24/h12-15H,5-11,16-23H2,1-4H3