N-[2-oxidanylidene-2-(2-piperidin-1-ium-1-ylethylamino)ethyl]-N-(phenylmethyl)furan-3-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-(2-piperidin-1-ium-1-ylethylamino)ethyl]-N-(phenylmethyl)furan-3-carboxamide Openeye Name: N-benzyl-N-[2-oxo-2-(2-piperidin-1-ium-1-ylethylamino)ethyl]furan-3-carboxamide CAS Name: N-[2-oxo-2-[2-(1-piperidin-1-iumyl)ethylamino]ethyl]-N-(phenylmethyl)-3-furancarboxamide IUPAC Name: N-benzyl-N-[2-oxo-2-(2-piperidin-1-ium-1-ylethylamino)ethyl]furan-3-carboxamide Traditional Name: N-benzyl-N-[2-keto-2-(2-piperidin-1-ium-1-ylethylamino)ethyl]-3-furamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)CN(CC2=CC=CC=C2)C(=O)C3=COC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)CN(CC2=CC=CC=C2)C(=O)C3=COC=C3

InChI

InChI=1S/C21H27N3O3/c25-20(22-10-13-23-11-5-2-6-12-23)16-24(15-18-7-3-1-4-8-18)21(26)19-9-14-27-17-19/h1,3-4,7-9,14,17H,2,5-6,10-13,15-16H2,(H,22,25)/p+1