methyl 4-[4-(5-butylpyridin-2-yl)piperidin-1-yl]sulfonyl-1-cyclopropyl-piperidine-4-carboxylate

Systemtic Name: methyl 4-[4-(5-butylpyridin-2-yl)piperidin-1-yl]sulfonyl-1-cyclopropyl-piperidine-4-carboxylate Openeye Name: methyl 4-[[4-(5-butyl-2-pyridyl)-1-piperidyl]sulfonyl]-1-cyclopropyl-piperidine-4-carboxylate CAS Name: 4-[[4-(5-butyl-2-pyridinyl)-1-piperidinyl]sulfonyl]-1-cyclopropyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(5-butylpyridin-2-yl)piperidin-1-yl]sulfonyl-1-cyclopropylpiperidine-4-carboxylate Traditional Name: 4-[4-(5-butyl-2-pyridyl)piperidino]sulfonyl-1-cyclopropyl-isonipecotic acid methyl ester Formula: C24H37N3O4S MolecularWeight: 463.63328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1)C2CCN(CC2)S(=O)(=O)C3(CCN(CC3)C4CC4)C(=O)OC

Isomeric SMILES

CCCCC1=CN=C(C=C1)C2CCN(CC2)S(=O)(=O)C3(CCN(CC3)C4CC4)C(=O)OC

InChI

InChI=1S/C24H37N3O4S/c1-3-4-5-19-6-9-22(25-18-19)20-10-14-27(15-11-20)32(29,30)24(23(28)31-2)12-16-26(17-13-24)21-7-8-21/h6,9,18,20-21H,3-5,7-8,10-17H2,1-2H3