1-cyclohexyl-3-[1-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]urea

Systemtic Name: 1-cyclohexyl-3-[1-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]urea Openeye Name: 1-cyclohexyl-3-[1-[2-(3-methoxyphenyl)-2-oxo-ethyl]piperidin-1-ium-4-yl]urea CAS Name: 1-cyclohexyl-3-[1-[2-(3-methoxyphenyl)-2-oxoethyl]-4-piperidin-1-iumyl]urea IUPAC Name: 1-cyclohexyl-3-[1-[2-(3-methoxyphenyl)-2-oxoethyl]piperidin-1-ium-4-yl]urea Traditional Name: 1-cyclohexyl-3-[1-[2-keto-2-(3-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]urea Formula: C21H32N3O3+ MolecularWeight: 374.49708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C[NH+]2CCC(CC2)NC(=O)NC3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C[NH+]2CCC(CC2)NC(=O)NC3CCCCC3

InChI

InChI=1S/C21H31N3O3/c1-27-19-9-5-6-16(14-19)20(25)15-24-12-10-18(11-13-24)23-21(26)22-17-7-3-2-4-8-17/h5-6,9,14,17-18H,2-4,7-8,10-13,15H2,1H3,(H2,22,23,26)/p+1