phenethyl 2-[(2S)-3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: phenethyl 2-[(2S)-3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: phenethyl 2-[(2S)-3-oxo-1-(4-propoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo-(4-propoxyphenyl)methyl]-2-piperazinyl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[(2S)-3-oxo-1-(4-propoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-1-(4-propoxybenzoyl)piperazin-2-yl]acetic acid phenethyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O5/c1-2-15-30-20-10-8-19(9-11-20)24(29)26-14-13-25-23(28)21(26)17-22(27)31-16-12-18-6-4-3-5-7-18/h3-11,21H,2,12-17H2,1H3,(H,25,28)/t21-/m0/s1