3-(2-bromoethyloxy)-2-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-(2-bromoethyloxy)-2-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid Openeye Name: 3-(2-bromoethoxy)-2-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid CAS Name: 3-(2-bromoethoxy)-2-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-(2-bromoethoxy)-2-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-(2-bromoethoxy)-2-[(4-but-2-ynoxyphenyl)sulfonylamino]propionic acid Formula: C15H18BrNO6S MolecularWeight: 420.27552

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(COCCBr)C(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(COCCBr)C(=O)O

InChI

InChI=1S/C15H18BrNO6S/c1-2-3-9-23-12-4-6-13(7-5-12)24(20,21)17-14(15(18)19)11-22-10-8-16/h4-7,14,17H,8-11H2,1H3,(H,18,19)