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

Systemtic Name: dodecyl 2-[1-[2-(2-ethoxyethoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-[2-(2-ethoxyethoxy)benzoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[2-(2-ethoxyethoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(2-ethoxyethoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(2-ethoxyethoxy)benzoyl]-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C29H46N2O6 MolecularWeight: 518.68534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCOCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCOCC

InChI

InChI=1S/C29H46N2O6/c1-3-5-6-7-8-9-10-11-12-15-20-37-27(32)23-25-28(33)30-18-19-31(25)29(34)24-16-13-14-17-26(24)36-22-21-35-4-2/h13-14,16-17,25H,3-12,15,18-23H2,1-2H3,(H,30,33)