dodecyl 2-[3-oxidanylidene-1-(3-propan-2-yloxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[3-oxidanylidene-1-(3-propan-2-yloxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-(3-isopropoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(3-propan-2-yloxyphenyl)methyl]-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[3-oxo-1-(3-propan-2-yloxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[1-(3-isopropoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C28H44N2O5 MolecularWeight: 488.65936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OC(C)C

InChI

InChI=1S/C28H44N2O5/c1-4-5-6-7-8-9-10-11-12-13-19-34-26(31)21-25-27(32)29-17-18-30(25)28(33)23-15-14-16-24(20-23)35-22(2)3/h14-16,20,22,25H,4-13,17-19,21H2,1-3H3,(H,29,32)