dodecyl 2-[3-oxidanylidene-1-[4-(oxolan-2-ylmethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[3-oxidanylidene-1-[4-(oxolan-2-ylmethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-[4-(tetrahydrofuran-2-ylmethoxy)benzoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-[4-(2-oxolanylmethoxy)phenyl]methyl]-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[3-oxo-1-[4-(oxolan-2-ylmethoxy)benzoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[4-(tetrahydrofurfuryloxy)benzoyl]piperazin-2-yl]acetic acid lauryl ester Formula: C30H46N2O6 MolecularWeight: 530.69604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)OCC3CCCO3

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)OCC3CCCO3

InChI

InChI=1S/C30H46N2O6/c1-2-3-4-5-6-7-8-9-10-11-20-37-28(33)22-27-29(34)31-18-19-32(27)30(35)24-14-16-25(17-15-24)38-23-26-13-12-21-36-26/h14-17,26-27H,2-13,18-23H2,1H3,(H,31,34)