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

Systemtic Name: dodecyl 2-[3-oxidanylidene-1-(3-phenylpropanoyl)piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-(3-phenylpropanoyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-(1-oxo-3-phenylpropyl)-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[3-oxo-1-(3-phenylpropanoyl)piperazin-2-yl]acetate Traditional Name: 2-(1-hydrocinnamoyl-3-keto-piperazin-2-yl)acetic acid lauryl ester Formula: C27H42N2O4 MolecularWeight: 458.63338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C27H42N2O4/c1-2-3-4-5-6-7-8-9-10-14-21-33-26(31)22-24-27(32)28-19-20-29(24)25(30)18-17-23-15-12-11-13-16-23/h11-13,15-16,24H,2-10,14,17-22H2,1H3,(H,28,32)