methyl (5Z)-5-[bromanyl(phenyl)methylidene]-2,4-bis(methylamino)pyrrole-3-carboxylate

Systemtic Name: methyl (5Z)-5-[bromanyl(phenyl)methylidene]-2,4-bis(methylamino)pyrrole-3-carboxylate Openeye Name: methyl (5Z)-5-[bromo(phenyl)methylene]-2,4-bis(methylamino)pyrrole-3-carboxylate CAS Name: (5Z)-5-[bromo(phenyl)methylidene]-2,4-bis(methylamino)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-5-[bromo(phenyl)methylidene]-2,4-bis(methylamino)pyrrole-3-carboxylate Traditional Name: (5Z)-5-[bromo(phenyl)methylene]-2,4-bis(methylamino)pyrrole-3-carboxylic acid methyl ester Formula: C15H16BrN3O2 MolecularWeight: 350.21044

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NC1=C(C2=CC=CC=C2)Br)NC)C(=O)OC

Isomeric SMILES

CNC\1=C(C(=N/C1=C(/C2=CC=CC=C2)\Br)NC)C(=O)OC

InChI

InChI=1S/C15H16BrN3O2/c1-17-12-10(15(20)21-3)14(18-2)19-13(12)11(16)9-7-5-4-6-8-9/h4-8,17H,1-3H3,(H,18,19)/b13-11-