[2-[(4-iodanyl-2-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[(4-iodanyl-2-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-(4-iodo-2-isopropyl-anilino)-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-(4-iodo-2-propan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-propan-2-ylanilino)-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(4-iodo-2-isopropyl-anilino)-2-keto-ethyl] ester Formula: C17H17IN2O3 MolecularWeight: 424.23295

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17IN2O3/c1-11(2)14-8-13(18)5-6-15(14)20-16(21)10-23-17(22)12-4-3-7-19-9-12/h3-9,11H,10H2,1-2H3,(H,20,21)