methyl 4-[4-[2-(acetamidomethyl)-5-oxidanylidene-1,2-oxazol-4-yl]phenyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[4-[2-(acetamidomethyl)-5-oxidanylidene-1,2-oxazol-4-yl]phenyl]piperazine-1-carboxylate Openeye Name: methyl 4-[4-[2-(acetamidomethyl)-5-oxo-isoxazol-4-yl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[2-(acetamidomethyl)-5-oxo-4-isoxazolyl]phenyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[2-(acetamidomethyl)-5-oxo-1,2-oxazol-4-yl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[2-(acetamidomethyl)-5-keto-3-isoxazolin-4-yl]phenyl]piperazine-1-carboxylic acid methyl ester Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCN1C=C(C(=O)O1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)OC

Isomeric SMILES

CC(=O)NCN1C=C(C(=O)O1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)OC

InChI

InChI=1S/C18H22N4O5/c1-13(23)19-12-22-11-16(17(24)27-22)14-3-5-15(6-4-14)20-7-9-21(10-8-20)18(25)26-2/h3-6,11H,7-10,12H2,1-2H3,(H,19,23)