[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-iodanylbenzoate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-iodanylbenzoate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C15H11IN2O5 MolecularWeight: 426.16271

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])I

InChI

InChI=1S/C15H11IN2O5/c16-11-3-1-10(2-4-11)15(20)23-9-14(19)17-12-5-7-13(8-6-12)18(21)22/h1-8H,9H2,(H,17,19)