phenanthridin-6-ylmethyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: phenanthridin-6-ylmethyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: phenanthridin-6-ylmethyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid phenanthridin-6-ylmethyl ester Formula: C19H13BrN2O2 MolecularWeight: 381.22272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N=C2COC(=O)C4=CC(=CN4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N=C2COC(=O)C4=CC(=CN4)Br

InChI

InChI=1S/C19H13BrN2O2/c20-12-9-17(21-10-12)19(23)24-11-18-15-7-2-1-5-13(15)14-6-3-4-8-16(14)22-18/h1-10,21H,11H2