1,3-benzodioxol-5-yl 2-methyl-6-phenyl-pyridine-3-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 2-methyl-6-phenyl-pyridine-3-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 2-methyl-6-phenyl-pyridine-3-carboxylate CAS Name: 2-methyl-6-phenyl-3-pyridinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-methyl-6-phenylpyridine-3-carboxylate Traditional Name: 2-methyl-6-phenyl-nicotinic acid 1,3-benzodioxol-5-yl ester Formula: C20H15NO4 MolecularWeight: 333.3374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H15NO4/c1-13-16(8-9-17(21-13)14-5-3-2-4-6-14)20(22)25-15-7-10-18-19(11-15)24-12-23-18/h2-11H,12H2,1H3