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

Systemtic Name: dodecyl 2-[1-[2-(2-chloranylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-[2-(2-chlorophenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-chlorophenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(2-chlorophenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(2-chlorophenoxy)propanoyl]-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C27H41ClN2O5 MolecularWeight: 509.07784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=CC=C2Cl

InChI

InChI=1S/C27H41ClN2O5/c1-3-4-5-6-7-8-9-10-11-14-19-34-25(31)20-23-26(32)29-17-18-30(23)27(33)21(2)35-24-16-13-12-15-22(24)28/h12-13,15-16,21,23H,3-11,14,17-20H2,1-2H3,(H,29,32)