2,2-bis(chloranyl)-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]ethanamide; hexadecanoate

Systemtic Name: 2,2-bis(chloranyl)-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]ethanamide; hexadecanoate Openeye Name: 2,2-dichloro-N-[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide; hexadecanoate CAS Name: 2,2-dichloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide; hexadecanoate IUPAC Name: 2,2-dichloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide; hexadecanoate Traditional Name: 2,2-dichloro-N-[2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]acetamide; palmitate Formula: C27H43Cl2N2O7- MolecularWeight: 578.54552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)[O-].C1=CC(=CC=C1C(C(CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)[O-].C1=CC(=CC=C1C(C(CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C16H32O2.C11H12Cl2N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h2-15H2,1H3,(H,17,18);1-4,8-10,16-17H,5H2,(H,14,18)/p-1