5-(4-ethanoylphenyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]furan-2-carboxamide

Systemtic Name: 5-(4-ethanoylphenyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]furan-2-carboxamide Openeye Name: 5-(4-acetylphenyl)-N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]furan-2-carboxamide CAS Name: 5-(4-acetylphenyl)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-2-furancarboxamide IUPAC Name: 5-(4-acetylphenyl)-N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]furan-2-carboxamide Traditional Name: 5-(4-acetylphenyl)-N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-furamide Formula: C24H25N2O3+ MolecularWeight: 389.4669

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3/c1-17(27)19-7-9-20(10-8-19)22-11-12-23(29-22)24(28)25-21-13-14-26(16-21)15-18-5-3-2-4-6-18/h2-12,21H,13-16H2,1H3,(H,25,28)/p+1/t21-/m0/s1