phenethyl 4-[2-(2-dodecoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[2-(2-dodecoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[2-(2-dodecoxy-2-oxo-ethyl)-3-oxo-piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[2-(2-dodecoxy-2-oxoethyl)-3-oxo-1-piperazinyl]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[2-(2-dodecoxy-2-oxoethyl)-3-oxopiperazin-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[3-keto-2-(2-keto-2-lauryloxy-ethyl)piperazino]butyric acid phenethyl ester Formula: C30H46N2O6 MolecularWeight: 530.69604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CCC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CCC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C30H46N2O6/c1-2-3-4-5-6-7-8-9-10-14-22-37-29(35)24-26-30(36)31-20-21-32(26)27(33)17-18-28(34)38-23-19-25-15-12-11-13-16-25/h11-13,15-16,26H,2-10,14,17-24H2,1H3,(H,31,36)