[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [2-(4-ethylanilino)-2-oxo-ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [2-(4-ethylanilino)-2-oxoethyl]-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [2-(4-ethylanilino)-2-oxoethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [2-(4-ethylanilino)-2-keto-ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C17H29N3O+2 MolecularWeight: 291.43166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C[NH+](C)C2CC[NH+](CC2)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C[NH+](C)C2CC[NH+](CC2)C

InChI

InChI=1S/C17H27N3O/c1-4-14-5-7-15(8-6-14)18-17(21)13-20(3)16-9-11-19(2)12-10-16/h5-8,16H,4,9-13H2,1-3H3,(H,18,21)/p+2