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

Systemtic Name: ethyl 4-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-bromo-1H-pyrrole-2-carboxylate CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4-bromo-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4-bromo-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C16H15BrN2O3 MolecularWeight: 363.2059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1)Br)C=CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1)Br)/C=C/C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H15BrN2O3/c1-2-22-16(21)15-12(13(17)10-18-15)8-9-14(20)19-11-6-4-3-5-7-11/h3-10,18H,2H2,1H3,(H,19,20)/b9-8+