(2S)-N-(furan-2-ylmethyl)-1-[(2-methylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(furan-2-ylmethyl)-1-[(2-methylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(2-furylmethyl)-1-(o-tolylmethyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-(2-furanylmethyl)-1-[(2-methylphenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-(furan-2-ylmethyl)-1-[(2-methylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(2-furfuryl)-1-(2-methylbenzyl)pyrrolidin-1-ium-2-carboxamide Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCCC2C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC[C@H]2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H22N2O2/c1-14-6-2-3-7-15(14)13-20-10-4-9-17(20)18(21)19-12-16-8-5-11-22-16/h2-3,5-8,11,17H,4,9-10,12-13H2,1H3,(H,19,21)/p+1/t17-/m0/s1