1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(5-methyl-1,2-oxazol-3-yl)urea

Systemtic Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(5-methyl-1,2-oxazol-3-yl)urea Openeye Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(5-methylisoxazol-3-yl)urea CAS Name: 1-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]-3-(5-methyl-3-isoxazolyl)urea IUPAC Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]-3-(5-methyl-1,2-oxazol-3-yl)urea Traditional Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(5-methylisoxazol-3-yl)urea Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)NCC(C2=CC=C(C=C2)OC)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)NC[C@@H](C2=CC=C(C=C2)OC)[NH+]3CCCCC3

InChI

InChI=1S/C19H26N4O3/c1-14-12-18(22-26-14)21-19(24)20-13-17(23-10-4-3-5-11-23)15-6-8-16(25-2)9-7-15/h6-9,12,17H,3-5,10-11,13H2,1-2H3,(H2,20,21,22,24)/p+1/t17-/m0/s1