2-methylpropyl 2-[1-[3-(2-ethoxyethoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[1-[3-(2-ethoxyethoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isobutyl 2-[1-[3-(2-ethoxyethoxy)benzoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[3-(2-ethoxyethoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[1-[3-(2-ethoxyethoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[3-(2-ethoxyethoxy)benzoyl]-3-keto-piperazin-2-yl]acetic acid isobutyl ester Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC(C)C

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC(C)C

InChI

InChI=1S/C21H30N2O6/c1-4-27-10-11-28-17-7-5-6-16(12-17)21(26)23-9-8-22-20(25)18(23)13-19(24)29-14-15(2)3/h5-7,12,15,18H,4,8-11,13-14H2,1-3H3,(H,22,25)