dimethyl-[(3S)-1-[[2-(phenoxymethyl)-1,3-oxazol-4-yl]carbonyl]pyrrolidin-3-yl]azanium

Systemtic Name: dimethyl-[(3S)-1-[[2-(phenoxymethyl)-1,3-oxazol-4-yl]carbonyl]pyrrolidin-3-yl]azanium Openeye Name: dimethyl-[(3S)-1-[2-(phenoxymethyl)oxazole-4-carbonyl]pyrrolidin-3-yl]ammonium CAS Name: dimethyl-[(3S)-1-[oxo-[2-(phenoxymethyl)-4-oxazolyl]methyl]-3-pyrrolidinyl]ammonium IUPAC Name: dimethyl-[(3S)-1-[2-(phenoxymethyl)-1,3-oxazole-4-carbonyl]pyrrolidin-3-yl]azanium Traditional Name: dimethyl-[(3S)-1-[2-(phenoxymethyl)oxazole-4-carbonyl]pyrrolidin-3-yl]ammonium Formula: C17H22N3O3+ MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1CCN(C1)C(=O)C2=COC(=N2)COC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H]1CCN(C1)C(=O)C2=COC(=N2)COC3=CC=CC=C3

InChI

InChI=1S/C17H21N3O3/c1-19(2)13-8-9-20(10-13)17(21)15-11-23-16(18-15)12-22-14-6-4-3-5-7-14/h3-7,11,13H,8-10,12H2,1-2H3/p+1/t13-/m0/s1