dodecyl 2-[1-(2,4-dinitrophenyl)-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-(2,4-dinitrophenyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-(2,4-dinitrophenyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(2,4-dinitrophenyl)-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-(2,4-dinitrophenyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(2,4-dinitrophenyl)-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C24H36N4O7 MolecularWeight: 492.56524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H36N4O7/c1-2-3-4-5-6-7-8-9-10-11-16-35-23(29)18-22-24(30)25-14-15-26(22)20-13-12-19(27(31)32)17-21(20)28(33)34/h12-13,17,22H,2-11,14-16,18H2,1H3,(H,25,30)