N-[(1R)-1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(1R)-1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(1R)-1-(3-fluoro-4-methoxy-phenyl)ethyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(1R)-1-(3-fluoro-4-methoxy-phenyl)ethyl]-3-piperidinosulfonyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)F)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@H](C1=CC(=C(C=C1)OC)F)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25FN2O4S/c1-15(16-9-10-20(28-2)19(22)14-16)23-21(25)17-7-6-8-18(13-17)29(26,27)24-11-4-3-5-12-24/h6-10,13-15H,3-5,11-12H2,1-2H3,(H,23,25)/t15-/m1/s1