ethyl 3-[[5-(pyrrolidin-1-ylmethyl)-1,2-oxazol-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[5-(pyrrolidin-1-ylmethyl)-1,2-oxazol-3-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[5-(pyrrolidin-1-ylmethyl)isoxazole-3-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[5-(1-pyrrolidinylmethyl)-3-isoxazolyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carbonyl]amino]benzoate Traditional Name: 3-[[5-(pyrrolidinomethyl)isoxazole-3-carbonyl]amino]benzoic acid ethyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=NOC(=C2)CN3CCCC3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=NOC(=C2)CN3CCCC3

InChI

InChI=1S/C18H21N3O4/c1-2-24-18(23)13-6-5-7-14(10-13)19-17(22)16-11-15(25-20-16)12-21-8-3-4-9-21/h5-7,10-11H,2-4,8-9,12H2,1H3,(H,19,22)