1-(4-methoxyphenyl)-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea

Systemtic Name: 1-(4-methoxyphenyl)-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea Openeye Name: 1-(4-methoxyphenyl)-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea CAS Name: 1-(4-methoxyphenyl)-3-[(2S)-4-methyl-2-(4-morpholin-4-iumyl)pentyl]urea IUPAC Name: 1-(4-methoxyphenyl)-3-[(2S)-4-methyl-2-morpholin-4-ium-4-ylpentyl]urea Traditional Name: 1-(4-methoxyphenyl)-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea Formula: C18H30N3O3+ MolecularWeight: 336.4491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)NC1=CC=C(C=C1)OC)[NH+]2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](CNC(=O)NC1=CC=C(C=C1)OC)[NH+]2CCOCC2

InChI

InChI=1S/C18H29N3O3/c1-14(2)12-16(21-8-10-24-11-9-21)13-19-18(22)20-15-4-6-17(23-3)7-5-15/h4-7,14,16H,8-13H2,1-3H3,(H2,19,20,22)/p+1/t16-/m0/s1