methyl 5-[(3-methyl-2-oxidanylidene-piperazin-1-yl)methyl]-1,2-oxazole-3-carboxylate

Systemtic Name: methyl 5-[(3-methyl-2-oxidanylidene-piperazin-1-yl)methyl]-1,2-oxazole-3-carboxylate Openeye Name: methyl 5-[(3-methyl-2-oxo-piperazin-1-yl)methyl]isoxazole-3-carboxylate CAS Name: 5-[(3-methyl-2-oxo-1-piperazinyl)methyl]-3-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-methyl-2-oxopiperazin-1-yl)methyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[(2-keto-3-methyl-piperazino)methyl]isoxazole-3-carboxylic acid methyl ester Formula: C11H15N3O4 MolecularWeight: 253.2545

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCN1)CC2=CC(=NO2)C(=O)OC

Isomeric SMILES

CC1C(=O)N(CCN1)CC2=CC(=NO2)C(=O)OC

InChI

InChI=1S/C11H15N3O4/c1-7-10(15)14(4-3-12-7)6-8-5-9(13-18-8)11(16)17-2/h5,7,12H,3-4,6H2,1-2H3