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

Systemtic Name: propan-2-yl 2-[(2S)-3-oxidanylidene-1-(2-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: isopropyl 2-[(2S)-3-oxo-1-(2-propoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo-(2-propoxyphenyl)methyl]-2-piperazinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(2S)-3-oxo-1-(2-propoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-1-(2-propoxybenzoyl)piperazin-2-yl]acetic acid isopropyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)N2CCNC(=O)C2CC(=O)OC(C)C

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)N2CCNC(=O)[C@@H]2CC(=O)OC(C)C

InChI

InChI=1S/C19H26N2O5/c1-4-11-25-16-8-6-5-7-14(16)19(24)21-10-9-20-18(23)15(21)12-17(22)26-13(2)3/h5-8,13,15H,4,9-12H2,1-3H3,(H,20,23)/t15-/m0/s1