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

Systemtic Name: cyclohexyl 2-[(2S)-3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: cyclohexyl 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 cyclohexyl ester IUPAC Name: cyclohexyl 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 cyclohexyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OC3CCCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OC3CCCCC3

InChI

InChI=1S/C22H30N2O5/c1-2-14-28-17-10-8-16(9-11-17)22(27)24-13-12-23-21(26)19(24)15-20(25)29-18-6-4-3-5-7-18/h8-11,18-19H,2-7,12-15H2,1H3,(H,23,26)/t19-/m0/s1