butyl 5-[[5-fluoranyl-1-(phenylsulfonyl)indol-3-yl]methyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: butyl 5-[[5-fluoranyl-1-(phenylsulfonyl)indol-3-yl]methyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: butyl 5-[[1-(benzenesulfonyl)-5-fluoro-indol-3-yl]methyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[[1-(benzenesulfonyl)-5-fluoro-3-indolyl]methyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid butyl ester IUPAC Name: butyl 5-[[1-(benzenesulfonyl)-5-fluoroindol-3-yl]methyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[(1-besyl-5-fluoro-indol-3-yl)methyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid butyl ester Formula: C25H27FN2O4S MolecularWeight: 470.556283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCC=C(C1)CC2=CN(C3=C2C=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)N1CCC=C(C1)CC2=CN(C3=C2C=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27FN2O4S/c1-2-3-14-32-25(29)27-13-7-8-19(17-27)15-20-18-28(24-12-11-21(26)16-23(20)24)33(30,31)22-9-5-4-6-10-22/h4-6,8-12,16,18H,2-3,7,13-15,17H2,1H3