1-[[(2R,4S)-2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium

Systemtic Name: 1-[[(2R,4S)-2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium Openeye Name: 1-[[(2R,4S)-2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium CAS Name: 1-[[(2R,4S)-2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium IUPAC Name: 1-[[(2R,4S)-2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium Traditional Name: 1-[[(2R,4S)-2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]pyrrolidin-1-ium Formula: C20H32NO2+ MolecularWeight: 318.47358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC2OCC(O2)C[NH+]3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CC[C@@H]2OC[C@@H](O2)C[NH+]3CCCC3

InChI

InChI=1S/C20H31NO2/c1-20(2,3)17-9-6-16(7-10-17)8-11-19-22-15-18(23-19)14-21-12-4-5-13-21/h6-7,9-10,18-19H,4-5,8,11-15H2,1-3H3/p+1/t18-,19+/m0/s1