methyl 3-methyl-5-[(3-oxidanylidenepiperazin-1-yl)methyl]furan-2-carboxylate

Systemtic Name: methyl 3-methyl-5-[(3-oxidanylidenepiperazin-1-yl)methyl]furan-2-carboxylate Openeye Name: methyl 3-methyl-5-[(3-oxopiperazin-1-yl)methyl]furan-2-carboxylate CAS Name: 3-methyl-5-[(3-oxo-1-piperazinyl)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[(3-oxopiperazin-1-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(3-ketopiperazino)methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2CCNC(=O)C2)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CN2CCNC(=O)C2)C(=O)OC

InChI

InChI=1S/C12H16N2O4/c1-8-5-9(18-11(8)12(16)17-2)6-14-4-3-13-10(15)7-14/h5H,3-4,6-7H2,1-2H3,(H,13,15)