3-[(3R)-1-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[(3R)-1-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[(3R)-1-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(3R)-1-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl]-3-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[(3R)-1-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(3R)-1-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-1-pyrrolidino-propan-1-one Formula: C21H30N3O2S+ MolecularWeight: 388.5468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCCC(C3)CCC(=O)N4CCCC4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCC[C@@H](C3)CCC(=O)N4CCCC4

InChI

InChI=1S/C21H29N3O2S/c1-16-18(22-21(26-16)19-7-5-13-27-19)15-23-10-4-6-17(14-23)8-9-20(25)24-11-2-3-12-24/h5,7,13,17H,2-4,6,8-12,14-15H2,1H3/p+1/t17-/m1/s1