(2S)-N-(furan-2-ylmethyl)-1-[2-(4-methylphenoxy)ethyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(furan-2-ylmethyl)-1-[2-(4-methylphenoxy)ethyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(2-furylmethyl)-1-[2-(4-methylphenoxy)ethyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-(2-furanylmethyl)-1-[2-(4-methylphenoxy)ethyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-(furan-2-ylmethyl)-1-[2-(4-methylphenoxy)ethyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(2-furfuryl)-1-[2-(4-methylphenoxy)ethyl]pyrrolidin-1-ium-2-carboxamide Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH+]2CCCC2C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH+]2CCC[C@H]2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C19H24N2O3/c1-15-6-8-16(9-7-15)24-13-11-21-10-2-5-18(21)19(22)20-14-17-4-3-12-23-17/h3-4,6-9,12,18H,2,5,10-11,13-14H2,1H3,(H,20,22)/p+1/t18-/m0/s1