3-(4-cyanophenyl)-1-(1-ethylpiperidin-1-ium-4-yl)-1-methyl-urea

Systemtic Name: 3-(4-cyanophenyl)-1-(1-ethylpiperidin-1-ium-4-yl)-1-methyl-urea Openeye Name: 3-(4-cyanophenyl)-1-(1-ethylpiperidin-1-ium-4-yl)-1-methyl-urea CAS Name: 3-(4-cyanophenyl)-1-(1-ethyl-4-piperidin-1-iumyl)-1-methylurea IUPAC Name: 3-(4-cyanophenyl)-1-(1-ethylpiperidin-1-ium-4-yl)-1-methylurea Traditional Name: 3-(4-cyanophenyl)-1-(1-ethylpiperidin-1-ium-4-yl)-1-methyl-urea Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)N(C)C(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CC[NH+]1CCC(CC1)N(C)C(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H22N4O/c1-3-20-10-8-15(9-11-20)19(2)16(21)18-14-6-4-13(12-17)5-7-14/h4-7,15H,3,8-11H2,1-2H3,(H,18,21)/p+1