ethyl 5-(1-methyl-2-oxidanylidene-azepan-3-yl)-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-(1-methyl-2-oxidanylidene-azepan-3-yl)-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-(1-methyl-2-oxo-azepan-3-yl)isoxazole-3-carboxylate CAS Name: 5-(1-methyl-2-oxo-3-azepanyl)-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1-methyl-2-oxoazepan-3-yl)-1,2-oxazole-3-carboxylate Traditional Name: 5-(2-keto-1-methyl-azepan-3-yl)isoxazole-3-carboxylic acid ethyl ester Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2CCCCN(C2=O)C

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2CCCCN(C2=O)C

InChI

InChI=1S/C13H18N2O4/c1-3-18-13(17)10-8-11(19-14-10)9-6-4-5-7-15(2)12(9)16/h8-9H,3-7H2,1-2H3