methyl 4,5-dimethoxy-2-(2-naphthalen-2-ylsulfanylethanoylamino)benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-(2-naphthalen-2-ylsulfanylethanoylamino)benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[2-(2-naphthylsulfanyl)acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[2-(2-naphthalenylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(2-naphthalen-2-ylsulfanylacetyl)amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[2-(2-naphthylthio)acetyl]amino]benzoic acid methyl ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CSC2=CC3=CC=CC=C3C=C2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CSC2=CC3=CC=CC=C3C=C2)OC

InChI

InChI=1S/C22H21NO5S/c1-26-19-11-17(22(25)28-3)18(12-20(19)27-2)23-21(24)13-29-16-9-8-14-6-4-5-7-15(14)10-16/h4-12H,13H2,1-3H3,(H,23,24)