2-azanyl-3-[(2-iodanylphenyl)-phenyl-methyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[(2-iodanylphenyl)-phenyl-methyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[(2-iodophenyl)-phenyl-methyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[(2-iodophenyl)-phenylmethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[(2-iodophenyl)-phenylmethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[(2-iodophenyl)-phenyl-methyl]thio]propionic acid Formula: C16H16INO2S MolecularWeight: 413.27321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2I)SCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2I)SCC(C(=O)O)N

InChI

InChI=1S/C16H16INO2S/c17-13-9-5-4-8-12(13)15(11-6-2-1-3-7-11)21-10-14(18)16(19)20/h1-9,14-15H,10,18H2,(H,19,20)