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

Systemtic Name: dodecyl 2-[1-[2-(2-butan-2-ylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-[2-(2-sec-butylphenoxy)propanoyl]piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-butan-2-ylphenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(2-butan-2-ylphenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(2-sec-butylphenoxy)propanoyl]piperazin-2-yl]acetic acid lauryl ester Formula: C31H50N2O5 MolecularWeight: 530.7391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H50N2O5/c1-5-7-8-9-10-11-12-13-14-17-22-37-29(34)23-27-30(35)32-20-21-33(27)31(36)25(4)38-28-19-16-15-18-26(28)24(3)6-2/h15-16,18-19,24-25,27H,5-14,17,20-23H2,1-4H3,(H,32,35)