[(2R)-oxolan-2-yl]methyl 2-[(2S)-1-(4-butoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: [(2R)-oxolan-2-yl]methyl 2-[(2S)-1-(4-butoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: [(2R)-tetrahydrofuran-2-yl]methyl 2-[(2S)-1-(4-butoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[(4-butoxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid [(2R)-2-oxolanyl]methyl ester IUPAC Name: [(2R)-oxolan-2-yl]methyl 2-[(2S)-1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(4-butoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid [(2R)-tetrahydrofuran-2-yl]methyl ester Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC3CCCO3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OC[C@H]3CCCO3

InChI

InChI=1S/C22H30N2O6/c1-2-3-12-28-17-8-6-16(7-9-17)22(27)24-11-10-23-21(26)19(24)14-20(25)30-15-18-5-4-13-29-18/h6-9,18-19H,2-5,10-15H2,1H3,(H,23,26)/t18-,19+/m1/s1