1-(5-methyl-1,2-oxazol-3-yl)-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea

Systemtic Name: 1-(5-methyl-1,2-oxazol-3-yl)-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea Openeye Name: 1-(5-methylisoxazol-3-yl)-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea CAS Name: 1-(5-methyl-3-isoxazolyl)-3-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]urea IUPAC Name: 1-(5-methyl-1,2-oxazol-3-yl)-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]urea Traditional Name: 1-(5-methylisoxazol-3-yl)-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C17H22N4O2/c1-13-11-16(20-23-13)19-17(22)18-12-15(21-9-5-6-10-21)14-7-3-2-4-8-14/h2-4,7-8,11,15H,5-6,9-10,12H2,1H3,(H2,18,19,20,22)/p+1/t15-/m0/s1