butyl 2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-5,6-dihydro-1,3-oxazine-5-carboxylate

Systemtic Name: butyl 2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-5,6-dihydro-1,3-oxazine-5-carboxylate Openeye Name: butyl 2-(p-tolyl)-4,4-bis(trifluoromethyl)-5,6-dihydro-1,3-oxazine-5-carboxylate CAS Name: 2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-5,6-dihydro-1,3-oxazine-5-carboxylic acid butyl ester IUPAC Name: butyl 2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-5,6-dihydro-1,3-oxazine-5-carboxylate Traditional Name: 2-(p-tolyl)-4,4-bis(trifluoromethyl)-5,6-dihydro-1,3-oxazine-5-carboxylic acid butyl ester Formula: C18H19F6NO3 MolecularWeight: 411.338779

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1COC(=NC1(C(F)(F)F)C(F)(F)F)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC(=O)C1COC(=NC1(C(F)(F)F)C(F)(F)F)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H19F6NO3/c1-3-4-9-27-15(26)13-10-28-14(12-7-5-11(2)6-8-12)25-16(13,17(19,20)21)18(22,23)24/h5-8,13H,3-4,9-10H2,1-2H3