phenethyl 2-[1-[2-(4-tert-butylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: phenethyl 2-[1-[2-(4-tert-butylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: phenethyl 2-[1-[2-(4-tert-butylphenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-tert-butylphenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[1-[2-(4-tert-butylphenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(4-tert-butylphenoxy)propanoyl]-3-keto-piperazin-2-yl]acetic acid phenethyl ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H34N2O5/c1-19(34-22-12-10-21(11-13-22)27(2,3)4)26(32)29-16-15-28-25(31)23(29)18-24(30)33-17-14-20-8-6-5-7-9-20/h5-13,19,23H,14-18H2,1-4H3,(H,28,31)