dodecyl 2-[1-[3,5-bis(chloranyl)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-[3,5-bis(chloranyl)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-(3,5-dichlorobenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(3,5-dichlorophenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-(3,5-dichlorobenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3,5-dichlorobenzoyl)-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C25H36Cl2N2O4 MolecularWeight: 499.47034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36Cl2N2O4/c1-2-3-4-5-6-7-8-9-10-11-14-33-23(30)18-22-24(31)28-12-13-29(22)25(32)19-15-20(26)17-21(27)16-19/h15-17,22H,2-14,18H2,1H3,(H,28,31)