butyl 2-[(2S)-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: butyl 2-[(2S)-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: butyl 2-[(2S)-1-(4-isopropoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo-(4-propan-2-yloxyphenyl)methyl]-2-piperazinyl]acetic acid butyl ester IUPAC Name: butyl 2-[(2S)-3-oxo-1-(4-propan-2-yloxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(4-isopropoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid butyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCCCOC(=O)C[C@H]1C(=O)NCCN1C(=O)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C20H28N2O5/c1-4-5-12-26-18(23)13-17-19(24)21-10-11-22(17)20(25)15-6-8-16(9-7-15)27-14(2)3/h6-9,14,17H,4-5,10-13H2,1-3H3,(H,21,24)/t17-/m0/s1