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3-[4-[[(2R)-2-azanyl-3-sulfanyl-propanoyl]amino]phenoxy]benzoic acid

3-[4-[[(2R)-2-azanyl-3-sulfanyl-propanoyl]amino]phenoxy]benzoic acid

Systemtic Name:3-[4-[[(2R)-2-azanyl-3-sulfanyl-propanoyl]amino]phenoxy]benzoic acid
Openeye Name:3-[4-[[(2R)-2-amino-3-sulfanyl-propanoyl]amino]phenoxy]benzoic acid
CAS Name:3-[4-[[(2R)-2-amino-3-mercapto-1-oxopropyl]amino]phenoxy]benzoic acid
IUPAC Name:3-[4-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]phenoxy]benzoic acid
Traditional Name:3-[4-[[(2R)-2-amino-3-mercapto-propanoyl]amino]phenoxy]benzoic acid
Formula: C16H16N2O4S
MolecularWeight: 332.37424
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC=C(C=C2)NC(=O)C(CS)N)C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC=C(C=C2)NC(=O)[C@H](CS)N)C(=O)O


InChI

InChI=1S/C16H16N2O4S/c17-14(9-23)15(19)18-11-4-6-12(7-5-11)22-13-3-1-2-10(8-13)16(20)21/h1-8,14,23H,9,17H2,(H,18,19)(H,20,21)/t14-/m0/s1


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