5-(3,5-dipropylpiperidin-1-yl)sulfonyl-2-piperidin-1-yl-benzoic acid

Systemtic Name: 5-(3,5-dipropylpiperidin-1-yl)sulfonyl-2-piperidin-1-yl-benzoic acid Openeye Name: 5-[(3,5-dipropyl-1-piperidyl)sulfonyl]-2-(1-piperidyl)benzoic acid CAS Name: 5-[(3,5-dipropyl-1-piperidinyl)sulfonyl]-2-(1-piperidinyl)benzoic acid IUPAC Name: 5-(3,5-dipropylpiperidin-1-yl)sulfonyl-2-piperidin-1-ylbenzoic acid Traditional Name: 5-(3,5-dipropylpiperidino)sulfonyl-2-piperidino-benzoic acid Formula: C23H36N2O4S MolecularWeight: 436.60794

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCCC3)C(=O)O)CCC

Isomeric SMILES

CCCC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCCC3)C(=O)O)CCC

InChI

InChI=1S/C23H36N2O4S/c1-3-8-18-14-19(9-4-2)17-25(16-18)30(28,29)20-10-11-22(21(15-20)23(26)27)24-12-6-5-7-13-24/h10-11,15,18-19H,3-9,12-14,16-17H2,1-2H3,(H,26,27)