2-[(4-methylsulfonylphenyl)methyl]pyridine-3-carbaldehyde

Systemtic Name: 2-[(4-methylsulfonylphenyl)methyl]pyridine-3-carbaldehyde Openeye Name: 2-[(4-methylsulfonylphenyl)methyl]pyridine-3-carbaldehyde CAS Name: 2-[(4-methylsulfonylphenyl)methyl]-3-pyridinecarboxaldehyde IUPAC Name: 2-[(4-methylsulfonylphenyl)methyl]pyridine-3-carbaldehyde Traditional Name: 2-(4-mesylbenzyl)nicotinaldehyde Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC2=C(C=CC=N2)C=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC2=C(C=CC=N2)C=O

InChI

InChI=1S/C14H13NO3S/c1-19(17,18)13-6-4-11(5-7-13)9-14-12(10-16)3-2-8-15-14/h2-8,10H,9H2,1H3