2-azanyl-2-[[(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)disulfanyl]methyl]-3-(4-methoxyphenyl)propanoic acid

Systemtic Name: 2-azanyl-2-[[(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)disulfanyl]methyl]-3-(4-methoxyphenyl)propanoic acid Openeye Name: 2-amino-2-[[(2-amino-3-hydroxy-3-oxo-propyl)disulfanyl]methyl]-3-(4-methoxyphenyl)propanoic acid CAS Name: 2-amino-2-[[(2-amino-3-hydroxy-3-oxopropyl)disulfanyl]methyl]-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 2-amino-2-[[(2-amino-3-hydroxy-3-oxopropyl)disulfanyl]methyl]-3-(4-methoxyphenyl)propanoic acid Traditional Name: 2-amino-2-[[(2-amino-3-hydroxy-3-keto-propyl)disulfanyl]methyl]-3-(4-methoxyphenyl)propionic acid Formula: C14H20N2O5S2 MolecularWeight: 360.449

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(CSSCC(C(=O)O)N)(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)CC(CSSCC(C(=O)O)N)(C(=O)O)N

InChI

InChI=1S/C14H20N2O5S2/c1-21-10-4-2-9(3-5-10)6-14(16,13(19)20)8-23-22-7-11(15)12(17)18/h2-5,11H,6-8,15-16H2,1H3,(H,17,18)(H,19,20)