N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoranyl-piperidin-4-yl]methyl]-3-methoxy-5-methyl-benzamide

Systemtic Name: N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoranyl-piperidin-4-yl]methyl]-3-methoxy-5-methyl-benzamide Openeye Name: N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoro-4-piperidyl]methyl]-3-methoxy-5-methyl-benzamide CAS Name: N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoro-4-piperidinyl]methyl]-3-methoxy-5-methylbenzamide IUPAC Name: N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoropiperidin-4-yl]methyl]-3-methoxy-5-methylbenzamide Traditional Name: N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoro-4-piperidyl]methyl]-3-methoxy-5-methyl-benzamide Formula: C21H33FN2O2 MolecularWeight: 364.497323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC2CCN(CC2F)CCC(C)(C)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC[C@H]2CCN(C[C@H]2F)CCC(C)(C)C)OC

InChI

InChI=1S/C21H33FN2O2/c1-15-10-17(12-18(11-15)26-5)20(25)23-13-16-6-8-24(14-19(16)22)9-7-21(2,3)4/h10-12,16,19H,6-9,13-14H2,1-5H3,(H,23,25)/t16-,19-/m1/s1