2-[4-[2-(naphthalen-1-ylmethylsulfanyl)ethanoylamino]phenoxy]ethanoate

Systemtic Name: 2-[4-[2-(naphthalen-1-ylmethylsulfanyl)ethanoylamino]phenoxy]ethanoate Openeye Name: 2-[4-[[2-(1-naphthylmethylsulfanyl)acetyl]amino]phenoxy]acetate CAS Name: 2-[4-[[2-(1-naphthalenylmethylthio)-1-oxoethyl]amino]phenoxy]acetate IUPAC Name: 2-[4-[[2-(naphthalen-1-ylmethylsulfanyl)acetyl]amino]phenoxy]acetate Traditional Name: 2-[4-[[2-(1-naphthylmethylthio)acetyl]amino]phenoxy]acetate Formula: C21H18NO4S- MolecularWeight: 380.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSCC(=O)NC3=CC=C(C=C3)OCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSCC(=O)NC3=CC=C(C=C3)OCC(=O)[O-]

InChI

InChI=1S/C21H19NO4S/c23-20(22-17-8-10-18(11-9-17)26-12-21(24)25)14-27-13-16-6-3-5-15-4-1-2-7-19(15)16/h1-11H,12-14H2,(H,22,23)(H,24,25)/p-1