ethyl 2-[1-(1-phenylcyclohexa-2,4-dien-1-yl)ethyl]pyridine-4-carboxylate

Systemtic Name: ethyl 2-[1-(1-phenylcyclohexa-2,4-dien-1-yl)ethyl]pyridine-4-carboxylate Openeye Name: ethyl 2-[1-(1-phenylcyclohexa-2,4-dien-1-yl)ethyl]pyridine-4-carboxylate CAS Name: 2-[1-(1-phenyl-1-cyclohexa-2,4-dienyl)ethyl]-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(1-phenylcyclohexa-2,4-dien-1-yl)ethyl]pyridine-4-carboxylate Traditional Name: 2-[1-(1-phenylcyclohexa-2,4-dien-1-yl)ethyl]isonicotinic acid ethyl ester Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC=C1)C(C)C2(CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=NC=C1)C(C)C2(CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO2/c1-3-25-21(24)18-12-15-23-20(16-18)17(2)22(13-8-5-9-14-22)19-10-6-4-7-11-19/h4-13,15-17H,3,14H2,1-2H3