2,5-dimethyl-N-[3-oxidanylidene-3-(2-pyrrolidin-1-ium-1-ylethylamino)propyl]-N-(phenylmethyl)furan-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[3-oxidanylidene-3-(2-pyrrolidin-1-ium-1-ylethylamino)propyl]-N-(phenylmethyl)furan-3-carboxamide Openeye Name: N-benzyl-2,5-dimethyl-N-[3-oxo-3-(2-pyrrolidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide CAS Name: 2,5-dimethyl-N-[3-oxo-3-[2-(1-pyrrolidin-1-iumyl)ethylamino]propyl]-N-(phenylmethyl)-3-furancarboxamide IUPAC Name: N-benzyl-2,5-dimethyl-N-[3-oxo-3-(2-pyrrolidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide Traditional Name: N-benzyl-N-[3-keto-3-(2-pyrrolidin-1-ium-1-ylethylamino)propyl]-2,5-dimethyl-3-furamide Formula: C23H32N3O3+ MolecularWeight: 398.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N(CCC(=O)NCC[NH+]2CCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N(CCC(=O)NCC[NH+]2CCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3/c1-18-16-21(19(2)29-18)23(28)26(17-20-8-4-3-5-9-20)14-10-22(27)24-11-15-25-12-6-7-13-25/h3-5,8-9,16H,6-7,10-15,17H2,1-2H3,(H,24,27)/p+1