methyl 2-cyano-1-[(Z)-2-iodanyl-3-phenyl-prop-2-enyl]-6-oxidanylidene-pyridine-4-carboxylate

Systemtic Name: methyl 2-cyano-1-[(Z)-2-iodanyl-3-phenyl-prop-2-enyl]-6-oxidanylidene-pyridine-4-carboxylate Openeye Name: methyl 2-cyano-1-[(Z)-2-iodo-3-phenyl-allyl]-6-oxo-pyridine-4-carboxylate CAS Name: 2-cyano-1-[(Z)-2-iodo-3-phenylprop-2-enyl]-6-oxo-4-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-cyano-1-[(Z)-2-iodo-3-phenylprop-2-enyl]-6-oxopyridine-4-carboxylate Traditional Name: 2-cyano-1-[(Z)-2-iodo-3-phenyl-allyl]-6-keto-isonicotinic acid methyl ester Formula: C17H13IN2O3 MolecularWeight: 420.20119

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)N(C(=C1)C#N)CC(=CC2=CC=CC=C2)I

Isomeric SMILES

COC(=O)C1=CC(=O)N(C(=C1)C#N)C/C(=C/C2=CC=CC=C2)/I

InChI

InChI=1S/C17H13IN2O3/c1-23-17(22)13-8-15(10-19)20(16(21)9-13)11-14(18)7-12-5-3-2-4-6-12/h2-9H,11H2,1H3/b14-7-