3,4-diethoxy-N-[2-[[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3,4-diethoxy-N-[2-[[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3,4-diethoxy-N-[2-[[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxo-ethyl]benzamide CAS Name: 3,4-diethoxy-N-[2-[[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]amino]-2-oxoethyl]benzamide IUPAC Name: 3,4-diethoxy-N-[2-[[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]amino]-2-oxoethyl]benzamide Traditional Name: 3,4-diethoxy-N-[2-[[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-keto-ethyl]benzamide Formula: C24H34N3O5+ MolecularWeight: 444.54386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCCC3)OCC

InChI

InChI=1S/C24H33N3O5/c1-3-30-21-11-10-18(15-22(21)31-4-2)24(29)26-17-23(28)25-16-19(20-9-8-14-32-20)27-12-6-5-7-13-27/h8-11,14-15,19H,3-7,12-13,16-17H2,1-2H3,(H,25,28)(H,26,29)/p+1/t19-/m0/s1