[2-phenyl-1-(1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl] ethanoate; sulfuric acid

Systemtic Name: [2-phenyl-1-(1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl] ethanoate; sulfuric acid Openeye Name: [1-(1-methyl-2-pyrrolidin-1-yl-ethyl)-2-phenyl-cyclohexyl] acetate; sulfuric acid CAS Name: acetic acid [2-phenyl-1-[1-(1-pyrrolidinyl)propan-2-yl]cyclohexyl] ester; sulfuric acid IUPAC Name: [2-phenyl-1-(1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl] acetate; sulfuric acid Traditional Name: acetic acid [1-(1-methyl-2-pyrrolidino-ethyl)-2-phenyl-cyclohexyl] ester; sulfuric acid Formula: C21H33NO6S MolecularWeight: 427.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCCC1)C2(CCCCC2C3=CC=CC=C3)OC(=O)C.OS(=O)(=O)O

Isomeric SMILES

CC(CN1CCCC1)C2(CCCCC2C3=CC=CC=C3)OC(=O)C.OS(=O)(=O)O

InChI

InChI=1S/C21H31NO2.H2O4S/c1-17(16-22-14-8-9-15-22)21(24-18(2)23)13-7-6-12-20(21)19-10-4-3-5-11-19;1-5(2,3)4/h3-5,10-11,17,20H,6-9,12-16H2,1-2H3;(H2,1,2,3,4)