4-(4-formamidopiperidin-1-yl)-3-methylsulfonyl-benzoic acid

Systemtic Name: 4-(4-formamidopiperidin-1-yl)-3-methylsulfonyl-benzoic acid Openeye Name: 4-(4-formamido-1-piperidyl)-3-methylsulfonyl-benzoic acid CAS Name: 4-(4-formamido-1-piperidinyl)-3-methylsulfonylbenzoic acid IUPAC Name: 4-(4-formamidopiperidin-1-yl)-3-methylsulfonylbenzoic acid Traditional Name: 4-(4-formamidopiperidino)-3-mesyl-benzoic acid Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)N2CCC(CC2)NC=O

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)N2CCC(CC2)NC=O

InChI

InChI=1S/C14H18N2O5S/c1-22(20,21)13-8-10(14(18)19)2-3-12(13)16-6-4-11(5-7-16)15-9-17/h2-3,8-9,11H,4-7H2,1H3,(H,15,17)(H,18,19)