2,4-bis(chloranyl)-6-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]phenolate

Systemtic Name: 2,4-bis(chloranyl)-6-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]phenolate Openeye Name: 2,4-dichloro-6-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]phenolate CAS Name: 2,4-dichloro-6-[[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]methyl]phenolate IUPAC Name: 2,4-dichloro-6-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]phenolate Traditional Name: 2,4-dichloro-6-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]phenolate Formula: C14H20Cl2N2O MolecularWeight: 303.2274

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNCC2=CC(=CC(=C2[O-])Cl)Cl

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNCC2=CC(=CC(=C2[O-])Cl)Cl

InChI

InChI=1S/C14H20Cl2N2O/c1-2-18-5-3-4-12(18)9-17-8-10-6-11(15)7-13(16)14(10)19/h6-7,12,17,19H,2-5,8-9H2,1H3/t12-/m0/s1