2-methoxy-N-[1-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 2-methoxy-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]-2-methoxy-benzamide CAS Name: 2-methoxy-N-[1-[2-oxo-2-(prop-2-enylamino)ethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 2-methoxy-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]-2-methoxy-benzamide Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NCC=C

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NCC=C

InChI

InChI=1S/C18H25N3O3/c1-3-10-19-17(22)13-21-11-8-14(9-12-21)20-18(23)15-6-4-5-7-16(15)24-2/h3-7,14H,1,8-13H2,2H3,(H,19,22)(H,20,23)/p+1