3,4,5-trimethoxy-N-[1-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[1-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[2-(allylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxy-benzamide CAS Name: 3,4,5-trimethoxy-N-[1-[2-oxo-2-(prop-2-enylamino)ethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[1-[2-oxo-2-(prop-2-enylamino)ethyl]piperidin-1-ium-4-yl]benzamide Traditional Name: N-[1-[2-(allylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxy-benzamide Formula: C20H30N3O5+ MolecularWeight: 392.4693

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2CC[NH+](CC2)CC(=O)NCC=C

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2CC[NH+](CC2)CC(=O)NCC=C

InChI

InChI=1S/C20H29N3O5/c1-5-8-21-18(24)13-23-9-6-15(7-10-23)22-20(25)14-11-16(26-2)19(28-4)17(12-14)27-3/h5,11-12,15H,1,6-10,13H2,2-4H3,(H,21,24)(H,22,25)/p+1