cyclohexyl 2-[1-(3-butoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: cyclohexyl 2-[1-(3-butoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: cyclohexyl 2-[1-(3-butoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(3-butoxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[1-(3-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3-butoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid cyclohexyl ester Formula: C23H32N2O5 MolecularWeight: 416.51058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OC3CCCCC3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OC3CCCCC3

InChI

InChI=1S/C23H32N2O5/c1-2-3-14-29-19-11-7-8-17(15-19)23(28)25-13-12-24-22(27)20(25)16-21(26)30-18-9-5-4-6-10-18/h7-8,11,15,18,20H,2-6,9-10,12-14,16H2,1H3,(H,24,27)