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

Systemtic Name: phenanthridin-6-ylmethyl 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: phenanthridin-6-ylmethyl 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid phenanthridin-6-ylmethyl ester Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C21H16N2O3/c1-13(24)14-10-19(22-11-14)21(25)26-12-20-17-8-3-2-6-15(17)16-7-4-5-9-18(16)23-20/h2-11,22H,12H2,1H3