methyl 2-[1-(4-ethylphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-ethylphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-(4-ethylbenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(4-ethylphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-ethylbenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-ethylbenzoyl)-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OC

InChI

InChI=1S/C16H20N2O4/c1-3-11-4-6-12(7-5-11)16(21)18-9-8-17-15(20)13(18)10-14(19)22-2/h4-7,13H,3,8-10H2,1-2H3,(H,17,20)