[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C14H11IN2O3 MolecularWeight: 382.15321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)NC(=O)COC(=O)C2=CN=CC=C2

Isomeric SMILES

C1=CC(=CC(=C1)I)NC(=O)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H11IN2O3/c15-11-4-1-5-12(7-11)17-13(18)9-20-14(19)10-3-2-6-16-8-10/h1-8H,9H2,(H,17,18)