4,5-bis(iodanyl)-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4,5-bis(iodanyl)-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4,5-diiodo-1H-pyrrole-2-carboxylic acid CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5-diiodo-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5-diiodo-1H-pyrrole-2-carboxylic acid Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4,5-diiodo-1H-pyrrole-2-carboxylic acid Formula: C14H10I2N2O3 MolecularWeight: 508.04974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C=CC2=C(NC(=C2I)I)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)/C=C/C2=C(NC(=C2I)I)C(=O)O

InChI

InChI=1S/C14H10I2N2O3/c15-11-9(12(14(20)21)18-13(11)16)6-7-10(19)17-8-4-2-1-3-5-8/h1-7,18H,(H,17,19)(H,20,21)/b7-6+