4-[5-(acetamidomethyl)thiophen-2-yl]sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid

Systemtic Name: 4-[5-(acetamidomethyl)thiophen-2-yl]sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid Openeye Name: 4-[[5-(acetamidomethyl)-2-thienyl]sulfonyloxy]-3-chloro-5-methoxy-benzoic acid CAS Name: 4-[[5-(acetamidomethyl)-2-thiophenyl]sulfonyloxy]-3-chloro-5-methoxybenzoic acid IUPAC Name: 4-[5-(acetamidomethyl)thiophen-2-yl]sulfonyloxy-3-chloro-5-methoxybenzoic acid Traditional Name: 4-[[5-(acetamidomethyl)-2-thienyl]sulfonyloxy]-3-chloro-5-methoxy-benzoic acid Formula: C15H14ClNO7S2 MolecularWeight: 419.85716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

InChI

InChI=1S/C15H14ClNO7S2/c1-8(18)17-7-10-3-4-13(25-10)26(21,22)24-14-11(16)5-9(15(19)20)6-12(14)23-2/h3-6H,7H2,1-2H3,(H,17,18)(H,19,20)