[4-chloranyl-2-[(2-chloranyl-4-nitro-phenyl)carbamoyl]phenyl] hexadecanoate

Systemtic Name: [4-chloranyl-2-[(2-chloranyl-4-nitro-phenyl)carbamoyl]phenyl] hexadecanoate Openeye Name: [4-chloro-2-[(2-chloro-4-nitro-phenyl)carbamoyl]phenyl] hexadecanoate CAS Name: hexadecanoic acid [4-chloro-2-[(2-chloro-4-nitroanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-chloro-2-[(2-chloro-4-nitrophenyl)carbamoyl]phenyl] hexadecanoate Traditional Name: palmitic acid [4-chloro-2-[(2-chloro-4-nitro-phenyl)carbamoyl]phenyl] ester Formula: C29H38Cl2N2O5 MolecularWeight: 565.52842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1=C(C=C(C=C1)Cl)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1=C(C=C(C=C1)Cl)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C29H38Cl2N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-28(34)38-27-19-16-22(30)20-24(27)29(35)32-26-18-17-23(33(36)37)21-25(26)31/h16-21H,2-15H2,1H3,(H,32,35)