2-(2-naphthalen-2-ylsulfanylethanoylamino)terephthalic acid

Systemtic Name: 2-(2-naphthalen-2-ylsulfanylethanoylamino)terephthalic acid Openeye Name: 2-[[2-(2-naphthylsulfanyl)acetyl]amino]terephthalic acid CAS Name: 2-[[2-(2-naphthalenylthio)-1-oxoethyl]amino]terephthalic acid IUPAC Name: 2-[(2-naphthalen-2-ylsulfanylacetyl)amino]terephthalic acid Traditional Name: 2-[[2-(2-naphthylthio)acetyl]amino]terephthalic acid Formula: C20H15NO5S MolecularWeight: 381.4018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H15NO5S/c22-18(11-27-15-7-5-12-3-1-2-4-13(12)9-15)21-17-10-14(19(23)24)6-8-16(17)20(25)26/h1-10H,11H2,(H,21,22)(H,23,24)(H,25,26)