2-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-3-yl]-1,3-benzoxazole

Systemtic Name: 2-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-3-yl]-1,3-benzoxazole Openeye Name: 2-[1-[2-(4-bromophenyl)sulfonylethyl]-3-piperidyl]-1,3-benzoxazole CAS Name: 2-[1-[2-(4-bromophenyl)sulfonylethyl]-3-piperidinyl]-1,3-benzoxazole IUPAC Name: 2-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-3-yl]-1,3-benzoxazole Traditional Name: 2-[1-(2-brosylethyl)-3-piperidyl]-1,3-benzoxazole Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCS(=O)(=O)C2=CC=C(C=C2)Br)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CC(CN(C1)CCS(=O)(=O)C2=CC=C(C=C2)Br)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H21BrN2O3S/c21-16-7-9-17(10-8-16)27(24,25)13-12-23-11-3-4-15(14-23)20-22-18-5-1-2-6-19(18)26-20/h1-2,5-10,15H,3-4,11-14H2