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

Systemtic Name: N-[1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide Openeye Name: N-[1-[2-(tert-butylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide CAS Name: N-[1-[2-(tert-butylamino)-2-oxoethyl]-4-piperidin-1-iumyl]-4-methoxybenzamide IUPAC Name: N-[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-4-methoxybenzamide Traditional Name: N-[1-[2-(tert-butylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide Formula: C19H30N3O3+ MolecularWeight: 348.4598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H29N3O3/c1-19(2,3)21-17(23)13-22-11-9-15(10-12-22)20-18(24)14-5-7-16(25-4)8-6-14/h5-8,15H,9-13H2,1-4H3,(H,20,24)(H,21,23)/p+1