4-(5-chloranylnaphthalen-2-yl)sulfonylbutanoic acid

Systemtic Name: 4-(5-chloranylnaphthalen-2-yl)sulfonylbutanoic acid Openeye Name: 4-[(5-chloro-2-naphthyl)sulfonyl]butanoic acid CAS Name: 4-[(5-chloro-2-naphthalenyl)sulfonyl]butanoic acid IUPAC Name: 4-(5-chloronaphthalen-2-yl)sulfonylbutanoic acid Traditional Name: 4-[(5-chloro-2-naphthyl)sulfonyl]butyric acid Formula: C14H13ClO4S MolecularWeight: 312.76862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)S(=O)(=O)CCCC(=O)O)C(=C1)Cl

Isomeric SMILES

C1=CC2=C(C=CC(=C2)S(=O)(=O)CCCC(=O)O)C(=C1)Cl

InChI

InChI=1S/C14H13ClO4S/c15-13-4-1-3-10-9-11(6-7-12(10)13)20(18,19)8-2-5-14(16)17/h1,3-4,6-7,9H,2,5,8H2,(H,16,17)