3,5-diethyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methoxy-6-oxidanyl-benzamide; methanesulfonate

Systemtic Name: 3,5-diethyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-methoxy-6-oxidanyl-benzamide; methanesulfonate Openeye Name: 3,5-diethyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxy-benzamide; methanesulfonate CAS Name: 3,5-diethyl-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-2-hydroxy-6-methoxybenzamide; methanesulfonate IUPAC Name: 3,5-diethyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxybenzamide; methanesulfonate Traditional Name: 3,5-diethyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxy-benzamide mesylate Formula: C20H34N2O6S MolecularWeight: 430.55876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1O)C(=O)NCC2CCC[NH+]2CC)OC)CC.CS(=O)(=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C(=C1O)C(=O)NC[C@@H]2CCC[NH+]2CC)OC)CC.CS(=O)(=O)[O-]

InChI

InChI=1S/C19H30N2O3.CH4O3S/c1-5-13-11-14(6-2)18(24-4)16(17(13)22)19(23)20-12-15-9-8-10-21(15)7-3;1-5(2,3)4/h11,15,22H,5-10,12H2,1-4H3,(H,20,23);1H3,(H,2,3,4)/t15-;/m0./s1