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

Systemtic Name: N-[(4-fluorophenyl)methyl]-N-[2-(4-heptanoylpiperazin-1-yl)ethyl]-3,3-dimethyl-butanamide Openeye Name: N-[(4-fluorophenyl)methyl]-N-[2-(4-heptanoylpiperazin-1-yl)ethyl]-3,3-dimethyl-butanamide CAS Name: N-[(4-fluorophenyl)methyl]-3,3-dimethyl-N-[2-[4-(1-oxoheptyl)-1-piperazinyl]ethyl]butanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-N-[2-(4-heptanoylpiperazin-1-yl)ethyl]-3,3-dimethylbutanamide Traditional Name: N-[2-(4-enanthylpiperazino)ethyl]-N-(4-fluorobenzyl)-3,3-dimethyl-butyramide Formula: C26H42FN3O2 MolecularWeight: 447.628983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H42FN3O2/c1-5-6-7-8-9-24(31)29-17-14-28(15-18-29)16-19-30(25(32)20-26(2,3)4)21-22-10-12-23(27)13-11-22/h10-13H,5-9,14-21H2,1-4H3