1-(2-methoxyphenyl)-3-[(3S)-piperidin-1-ium-3-yl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[(3S)-piperidin-1-ium-3-yl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[(3S)-piperidin-1-ium-3-yl]urea CAS Name: 1-(2-methoxyphenyl)-3-[(3S)-3-piperidin-1-iumyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[(3S)-piperidin-1-ium-3-yl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[(3S)-piperidin-1-ium-3-yl]urea Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)NC2CCC[NH2+]C2

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C13H19N3O2/c1-18-12-7-3-2-6-11(12)16-13(17)15-10-5-4-8-14-9-10/h2-3,6-7,10,14H,4-5,8-9H2,1H3,(H2,15,16,17)/p+1/t10-/m0/s1