(2S)-N-(furan-2-ylmethyl)-1-[(2-methoxy-5-methyl-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(furan-2-ylmethyl)-1-[(2-methoxy-5-methyl-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(2-furylmethyl)-1-[(2-methoxy-5-methyl-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-(2-furanylmethyl)-1-[(2-methoxy-5-methylphenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-(furan-2-ylmethyl)-1-[(2-methoxy-5-methylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(2-furfuryl)-1-(2-methoxy-5-methyl-benzyl)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)OC)C[NH+]2CCCC2C(=O)NCC3=CC=CO3

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3/c1-14-7-8-18(23-2)15(11-14)13-21-9-3-6-17(21)19(22)20-12-16-5-4-10-24-16/h4-5,7-8,10-11,17H,3,6,9,12-13H2,1-2H3,(H,20,22)/p+1/t17-/m0/s1