dodecyl 2-[1-[2-(2,6-dimethylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-[2-(2,6-dimethylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-[2-(2,6-dimethylphenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2,6-dimethylphenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(2,6-dimethylphenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(2,6-dimethylphenoxy)propanoyl]-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C29H46N2O5 MolecularWeight: 502.68594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H46N2O5/c1-5-6-7-8-9-10-11-12-13-14-20-35-26(32)21-25-28(33)30-18-19-31(25)29(34)24(4)36-27-22(2)16-15-17-23(27)3/h15-17,24-25H,5-14,18-21H2,1-4H3,(H,30,33)