1-(4-butoxyphenyl)-3-piperidin-1-yl-propan-1-one; sulfuric acid

Systemtic Name: 1-(4-butoxyphenyl)-3-piperidin-1-yl-propan-1-one; sulfuric acid Openeye Name: 1-(4-butoxyphenyl)-3-(1-piperidyl)propan-1-one; sulfuric acid CAS Name: 1-(4-butoxyphenyl)-3-(1-piperidinyl)-1-propanone; sulfuric acid IUPAC Name: 1-(4-butoxyphenyl)-3-piperidin-1-ylpropan-1-one; sulfuric acid Traditional Name: 1-(4-butoxyphenyl)-3-piperidino-propan-1-one; sulfuric acid Formula: C18H29NO6S MolecularWeight: 387.49096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.OS(=O)(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.OS(=O)(=O)O

InChI

InChI=1S/C18H27NO2.H2O4S/c1-2-3-15-21-17-9-7-16(8-10-17)18(20)11-14-19-12-5-4-6-13-19;1-5(2,3)4/h7-10H,2-6,11-15H2,1H3;(H2,1,2,3,4)