[(E)-[2-(4-chlorophenyl)-1-methylsulfonyl-2,3-dihydroquinolin-4-ylidene]amino] methanesulfonate

Systemtic Name: [(E)-[2-(4-chlorophenyl)-1-methylsulfonyl-2,3-dihydroquinolin-4-ylidene]amino] methanesulfonate Openeye Name: [(E)-[2-(4-chlorophenyl)-1-methylsulfonyl-2,3-dihydroquinolin-4-ylidene]amino] methanesulfonate CAS Name: methanesulfonic acid [(E)-[2-(4-chlorophenyl)-1-methylsulfonyl-2,3-dihydroquinolin-4-ylidene]amino] ester IUPAC Name: [(E)-[2-(4-chlorophenyl)-1-methylsulfonyl-2,3-dihydroquinolin-4-ylidene]amino] methanesulfonate Traditional Name: methanesulfonic acid [(E)-[2-(4-chlorophenyl)-1-mesyl-2,3-dihydroquinolin-4-ylidene]amino] ester Formula: C17H17ClN2O5S2 MolecularWeight: 428.91028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(CC(=NOS(=O)(=O)C)C2=CC=CC=C21)C3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)N1C(C/C(=N\OS(=O)(=O)C)/C2=CC=CC=C21)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN2O5S2/c1-26(21,22)20-16-6-4-3-5-14(16)15(19-25-27(2,23)24)11-17(20)12-7-9-13(18)10-8-12/h3-10,17H,11H2,1-2H3/b19-15+