N-[[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-3-yl]methyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-3-yl]methyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[[1-[(2-fluoro-4-methoxy-phenyl)methyl]-3-piperidyl]methyl]-4-methoxy-benzenesulfonamide CAS Name: N-[[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-piperidinyl]methyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[[1-[(2-fluoro-4-methoxyphenyl)methyl]piperidin-3-yl]methyl]-4-methoxybenzenesulfonamide Traditional Name: N-[[1-(2-fluoro-4-methoxy-benzyl)-3-piperidyl]methyl]-4-methoxy-benzenesulfonamide Formula: C21H27FN2O4S MolecularWeight: 422.513483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)CC3=C(C=C(C=C3)OC)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)CC3=C(C=C(C=C3)OC)F

InChI

InChI=1S/C21H27FN2O4S/c1-27-18-7-9-20(10-8-18)29(25,26)23-13-16-4-3-11-24(14-16)15-17-5-6-19(28-2)12-21(17)22/h5-10,12,16,23H,3-4,11,13-15H2,1-2H3