ethyl 4,5-bis(bromanyl)-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4,5-bis(bromanyl)-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4,5-dibromo-1H-pyrrole-2-carboxylate CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5-dibromo-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5-dibromo-1H-pyrrole-2-carboxylate Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4,5-dibromo-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C16H14Br2N2O3 MolecularWeight: 442.10196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)Br)Br)C=CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)Br)Br)/C=C/C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H14Br2N2O3/c1-2-23-16(22)14-11(13(17)15(18)20-14)8-9-12(21)19-10-6-4-3-5-7-10/h3-9,20H,2H2,1H3,(H,19,21)/b9-8+