2-[(4-bromophenyl)methyl]-5-ethylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[(4-bromophenyl)methyl]-5-ethylsulfonyl-1,3-benzoxazole Openeye Name: 2-[(4-bromophenyl)methyl]-5-ethylsulfonyl-1,3-benzoxazole CAS Name: 2-[(4-bromophenyl)methyl]-5-ethylsulfonyl-1,3-benzoxazole IUPAC Name: 2-[(4-bromophenyl)methyl]-5-ethylsulfonyl-1,3-benzoxazole Traditional Name: 2-(4-bromobenzyl)-5-esyl-1,3-benzoxazole Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrNO3S/c1-2-22(19,20)13-7-8-15-14(10-13)18-16(21-15)9-11-3-5-12(17)6-4-11/h3-8,10H,2,9H2,1H3