ethyl 3-[4-(4-methylsulfonylphenyl)pyridin-3-yl]carbonylbenzoate

Systemtic Name: ethyl 3-[4-(4-methylsulfonylphenyl)pyridin-3-yl]carbonylbenzoate Openeye Name: ethyl 3-[4-(4-methylsulfonylphenyl)pyridine-3-carbonyl]benzoate CAS Name: 3-[[4-(4-methylsulfonylphenyl)-3-pyridinyl]-oxomethyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-methylsulfonylphenyl)pyridine-3-carbonyl]benzoate Traditional Name: 3-[4-(4-mesylphenyl)nicotinoyl]benzoic acid ethyl ester Formula: C22H19NO5S MolecularWeight: 409.45496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C(=O)C2=C(C=CN=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C(=O)C2=C(C=CN=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H19NO5S/c1-3-28-22(25)17-6-4-5-16(13-17)21(24)20-14-23-12-11-19(20)15-7-9-18(10-8-15)29(2,26)27/h4-14H,3H2,1-2H3