(2S)-2-azanyl-4-[2-(4-methoxyphenyl)-1,3-dithiolan-2-yl]butanoic acid

Systemtic Name: (2S)-2-azanyl-4-[2-(4-methoxyphenyl)-1,3-dithiolan-2-yl]butanoic acid Openeye Name: (2S)-2-amino-4-[2-(4-methoxyphenyl)-1,3-dithiolan-2-yl]butanoic acid CAS Name: (2S)-2-amino-4-[2-(4-methoxyphenyl)-1,3-dithiolan-2-yl]butanoic acid IUPAC Name: (2S)-2-amino-4-[2-(4-methoxyphenyl)-1,3-dithiolan-2-yl]butanoic acid Traditional Name: (2S)-2-amino-4-[2-(4-methoxyphenyl)-1,3-dithiolan-2-yl]butyric acid Formula: C14H19NO3S2 MolecularWeight: 313.43556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(SCCS2)CCC(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2(SCCS2)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C14H19NO3S2/c1-18-11-4-2-10(3-5-11)14(19-8-9-20-14)7-6-12(15)13(16)17/h2-5,12H,6-9,15H2,1H3,(H,16,17)/t12-/m0/s1