4-bromanyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-bromanyl-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-bromo-1H-pyrrole-2-carboxylic acid CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4-bromo-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4-bromo-1H-pyrrole-2-carboxylic acid Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4-bromo-1H-pyrrole-2-carboxylic acid Formula: C14H11BrN2O3 MolecularWeight: 335.15274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C=CC2=C(NC=C2Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)/C=C/C2=C(NC=C2Br)C(=O)O

InChI

InChI=1S/C14H11BrN2O3/c15-11-8-16-13(14(19)20)10(11)6-7-12(18)17-9-4-2-1-3-5-9/h1-8,16H,(H,17,18)(H,19,20)/b7-6+