(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl naphthalene-1-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl naphthalene-1-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C22H16ClNO2S MolecularWeight: 393.88594

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H16ClNO2S/c1-27-17-10-9-15-11-16(21(23)24-20(15)12-17)13-26-22(25)19-8-4-6-14-5-2-3-7-18(14)19/h2-12H,13H2,1H3