(5-bromanyl-1,2-benzoxazol-3-yl) 4-acetamidobenzenesulfonate

Systemtic Name: (5-bromanyl-1,2-benzoxazol-3-yl) 4-acetamidobenzenesulfonate Openeye Name: (5-bromo-1,2-benzoxazol-3-yl) 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid (5-bromo-1,2-benzoxazol-3-yl) ester IUPAC Name: (5-bromo-1,2-benzoxazol-3-yl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (5-bromoindoxazen-3-yl) ester Formula: C15H11BrN2O5S MolecularWeight: 411.22724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=NOC3=C2C=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=NOC3=C2C=C(C=C3)Br

InChI

InChI=1S/C15H11BrN2O5S/c1-9(19)17-11-3-5-12(6-4-11)24(20,21)23-15-13-8-10(16)2-7-14(13)22-18-15/h2-8H,1H3,(H,17,19)