2-[3-chloranylpropyl-(4-methoxyphenyl)sulfonyl-amino]prop-2-enoic acid

Systemtic Name: 2-[3-chloranylpropyl-(4-methoxyphenyl)sulfonyl-amino]prop-2-enoic acid Openeye Name: 2-[3-chloropropyl-(4-methoxyphenyl)sulfonyl-amino]prop-2-enoic acid CAS Name: 2-[3-chloropropyl-(4-methoxyphenyl)sulfonylamino]-2-propenoic acid IUPAC Name: 2-[3-chloropropyl-(4-methoxyphenyl)sulfonylamino]prop-2-enoic acid Traditional Name: 2-[3-chloropropyl-(4-methoxyphenyl)sulfonyl-amino]acrylic acid Formula: C13H16ClNO5S MolecularWeight: 333.78784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CCCCl)C(=C)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CCCCl)C(=C)C(=O)O

InChI

InChI=1S/C13H16ClNO5S/c1-10(13(16)17)15(9-3-8-14)21(18,19)12-6-4-11(20-2)5-7-12/h4-7H,1,3,8-9H2,2H3,(H,16,17)