dodecyl 2-[1-[2-(2-butan-2-ylphenoxy)butanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-[2-(2-butan-2-ylphenoxy)butanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-[2-(2-sec-butylphenoxy)butanoyl]piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-butan-2-ylphenoxy)-1-oxobutyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(2-butan-2-ylphenoxy)butanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(2-sec-butylphenoxy)butanoyl]piperazin-2-yl]acetic acid lauryl ester Formula: C32H52N2O5 MolecularWeight: 544.76568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C(CC)OC2=CC=CC=C2C(C)CC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C(CC)OC2=CC=CC=C2C(C)CC

InChI

InChI=1S/C32H52N2O5/c1-5-8-9-10-11-12-13-14-15-18-23-38-30(35)24-27-31(36)33-21-22-34(27)32(37)28(7-3)39-29-20-17-16-19-26(29)25(4)6-2/h16-17,19-20,25,27-28H,5-15,18,21-24H2,1-4H3,(H,33,36)