2-methylpropyl 2-[1-(4-butan-2-yloxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[1-(4-butan-2-yloxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isobutyl 2-[3-oxo-1-(4-sec-butoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[1-[(4-butan-2-yloxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[1-(4-butan-2-yloxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(4-sec-butoxybenzoyl)piperazin-2-yl]acetic acid isobutyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC(C)C

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC(C)C

InChI

InChI=1S/C21H30N2O5/c1-5-15(4)28-17-8-6-16(7-9-17)21(26)23-11-10-22-20(25)18(23)12-19(24)27-13-14(2)3/h6-9,14-15,18H,5,10-13H2,1-4H3,(H,22,25)