phenyl 4-butyl-3-(2-ethoxy-2-oxidanylidene-ethyl)-4H-pyridine-1-carboxylate

Systemtic Name: phenyl 4-butyl-3-(2-ethoxy-2-oxidanylidene-ethyl)-4H-pyridine-1-carboxylate Openeye Name: phenyl 4-butyl-3-(2-ethoxy-2-oxo-ethyl)-4H-pyridine-1-carboxylate CAS Name: 4-butyl-3-(2-ethoxy-2-oxoethyl)-4H-pyridine-1-carboxylic acid phenyl ester IUPAC Name: phenyl 4-butyl-3-(2-ethoxy-2-oxoethyl)-4H-pyridine-1-carboxylate Traditional Name: 4-butyl-3-(2-ethoxy-2-keto-ethyl)-4H-pyridine-1-carboxylic acid phenyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=CN(C=C1CC(=O)OCC)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCC1C=CN(C=C1CC(=O)OCC)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C20H25NO4/c1-3-5-9-16-12-13-21(15-17(16)14-19(22)24-4-2)20(23)25-18-10-7-6-8-11-18/h6-8,10-13,15-16H,3-5,9,14H2,1-2H3