N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-2-bromanyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-2-bromanyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(1-norbornan-2-ylethyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-2-bromo-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-2-bromo-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[1-(2-norbornyl)ethyl]-5-piperidinosulfonyl-benzamide Formula: C21H29BrN2O3S MolecularWeight: 469.43556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC2CCC1C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Br

Isomeric SMILES

CC(C1CC2CCC1C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Br

InChI

InChI=1S/C21H29BrN2O3S/c1-14(18-12-15-5-6-16(18)11-15)23-21(25)19-13-17(7-8-20(19)22)28(26,27)24-9-3-2-4-10-24/h7-8,13-16,18H,2-6,9-12H2,1H3,(H,23,25)