(2-oxidanylidene-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 3-methoxy-2-methyl-4-methylsulfonyl-benzoate

Systemtic Name: (2-oxidanylidene-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 3-methoxy-2-methyl-4-methylsulfonyl-benzoate Openeye Name: (2-oxo-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 3-methoxy-2-methyl-4-methylsulfonyl-benzoate CAS Name: 3-methoxy-2-methyl-4-methylsulfonylbenzoic acid (2-oxo-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) ester IUPAC Name: (2-oxo-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 3-methoxy-2-methyl-4-methylsulfonylbenzoate Traditional Name: 4-mesyl-3-methoxy-2-methyl-benzoic acid (2-keto-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) ester Formula: C25H25NO6S MolecularWeight: 467.5341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)OC2=CC(=O)N(C3=C2CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)OC2=CC(=O)N(C3=C2CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H25NO6S/c1-16-18(13-14-22(24(16)31-2)33(3,29)30)25(28)32-21-15-23(27)26(17-9-5-4-6-10-17)20-12-8-7-11-19(20)21/h4-6,9-10,13-15H,7-8,11-12H2,1-3H3