phenanthridin-6-ylmethyl 2,4,5-trimethylfuran-3-carboxylate

Systemtic Name: phenanthridin-6-ylmethyl 2,4,5-trimethylfuran-3-carboxylate Openeye Name: phenanthridin-6-ylmethyl 2,4,5-trimethylfuran-3-carboxylate CAS Name: 2,4,5-trimethyl-3-furancarboxylic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 2,4,5-trimethylfuran-3-carboxylate Traditional Name: 2,4,5-trimethylfuran-3-carboxylic acid phenanthridin-6-ylmethyl ester Formula: C22H19NO3 MolecularWeight: 345.39116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)C)C

Isomeric SMILES

CC1=C(OC(=C1C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)C)C

InChI

InChI=1S/C22H19NO3/c1-13-14(2)26-15(3)21(13)22(24)25-12-20-18-10-5-4-8-16(18)17-9-6-7-11-19(17)23-20/h4-11H,12H2,1-3H3