[4-(dodecanoylamino)phenyl] 2-nitrobenzoate

Systemtic Name: [4-(dodecanoylamino)phenyl] 2-nitrobenzoate Openeye Name: [4-(dodecanoylamino)phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [4-(1-oxododecylamino)phenyl] ester IUPAC Name: [4-(dodecanoylamino)phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [4-(lauroylamino)phenyl] ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C25H32N2O5/c1-2-3-4-5-6-7-8-9-10-15-24(28)26-20-16-18-21(19-17-20)32-25(29)22-13-11-12-14-23(22)27(30)31/h11-14,16-19H,2-10,15H2,1H3,(H,26,28)