4-[4-(4-chlorophenyl)sulfanylbutanoylamino]butanoic acid

Systemtic Name: 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]butanoic acid Openeye Name: 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]butanoic acid CAS Name: 4-[[4-[(4-chlorophenyl)thio]-1-oxobutyl]amino]butanoic acid IUPAC Name: 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]butanoic acid Traditional Name: 4-[4-[(4-chlorophenyl)thio]butanoylamino]butyric acid Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCCC(=O)NCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1SCCCC(=O)NCCCC(=O)O)Cl

InChI

InChI=1S/C14H18ClNO3S/c15-11-5-7-12(8-6-11)20-10-2-3-13(17)16-9-1-4-14(18)19/h5-8H,1-4,9-10H2,(H,16,17)(H,18,19)