8-[(3-phenacylsulfanylphenyl)carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[(3-phenacylsulfanylphenyl)carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[(3-phenacylsulfanylphenyl)carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[oxo-[3-(phenacylthio)anilino]methyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[(3-phenacylsulfanylphenyl)carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[3-(phenacylthio)phenyl]carbamoyl]-1-naphthoic acid Formula: C26H19NO4S MolecularWeight: 441.49836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

InChI

InChI=1S/C26H19NO4S/c28-23(17-7-2-1-3-8-17)16-32-20-12-6-11-19(15-20)27-25(29)21-13-4-9-18-10-5-14-22(24(18)21)26(30)31/h1-15H,16H2,(H,27,29)(H,30,31)