methyl 2-[3-oxidanylidene-1-[(3-phenethyl-1,2-oxazol-5-yl)carbonyl]piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[3-oxidanylidene-1-[(3-phenethyl-1,2-oxazol-5-yl)carbonyl]piperazin-2-yl]ethanoate Openeye Name: methyl 2-[3-oxo-1-(3-phenethylisoxazole-5-carbonyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(3-phenethyl-5-isoxazolyl)methyl]-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-oxo-1-(3-phenethyl-1,2-oxazole-5-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(3-phenethylisoxazole-5-carbonyl)piperazin-2-yl]acetic acid methyl ester Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=NO2)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=NO2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O5/c1-26-17(23)12-15-18(24)20-9-10-22(15)19(25)16-11-14(21-27-16)8-7-13-5-3-2-4-6-13/h2-6,11,15H,7-10,12H2,1H3,(H,20,24)