N-[2-[[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[2-[[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]-3,5-dimethoxy-benzamide Openeye Name: N-[2-[[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxo-ethyl]-3,5-dimethoxy-benzamide CAS Name: N-[2-[[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]amino]-2-oxoethyl]-3,5-dimethoxybenzamide IUPAC Name: N-[2-[[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]amino]-2-oxoethyl]-3,5-dimethoxybenzamide Traditional Name: N-[2-[[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-keto-ethyl]-3,5-dimethoxy-benzamide Formula: C22H30N3O5+ MolecularWeight: 416.4907

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCC(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCCC3)OC

InChI

InChI=1S/C22H29N3O5/c1-28-17-11-16(12-18(13-17)29-2)22(27)24-15-21(26)23-14-19(20-7-6-10-30-20)25-8-4-3-5-9-25/h6-7,10-13,19H,3-5,8-9,14-15H2,1-2H3,(H,23,26)(H,24,27)/p+1/t19-/m0/s1