2-hydroxyethyl-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: 2-hydroxyethyl-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-(2-hydroxyethyl)-[[5-methyl-2-(3-thienyl)oxazol-4-yl]methyl]ammonium CAS Name: 2-hydroxyethyl-[[5-methyl-2-(3-thiophenyl)-4-oxazolyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-hydroxyethyl)-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]azanium Traditional Name: benzyl-(2-hydroxyethyl)-[[5-methyl-2-(3-thienyl)oxazol-4-yl]methyl]ammonium Formula: C18H21N2O2S+ MolecularWeight: 329.43654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CSC=C2)C[NH+](CCO)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(O1)C2=CSC=C2)C[NH+](CCO)CC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c1-14-17(19-18(22-14)16-7-10-23-13-16)12-20(8-9-21)11-15-5-3-2-4-6-15/h2-7,10,13,21H,8-9,11-12H2,1H3/p+1