5-methylsulfonyl-2,4-di(piperidin-1-yl)benzoic acid

Systemtic Name: 5-methylsulfonyl-2,4-di(piperidin-1-yl)benzoic acid Openeye Name: 5-methylsulfonyl-2,4-bis(1-piperidyl)benzoic acid CAS Name: 5-methylsulfonyl-2,4-bis(1-piperidinyl)benzoic acid IUPAC Name: 5-methylsulfonyl-2,4-di(piperidin-1-yl)benzoic acid Traditional Name: 5-mesyl-2,4-dipiperidino-benzoic acid Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)N2CCCCC2)N3CCCCC3

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)N2CCCCC2)N3CCCCC3

InChI

InChI=1S/C18H26N2O4S/c1-25(23,24)17-12-14(18(21)22)15(19-8-4-2-5-9-19)13-16(17)20-10-6-3-7-11-20/h12-13H,2-11H2,1H3,(H,21,22)