7,7-dimethyl-1,2-bis(phenylmethyl)-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-ium-5-one

Systemtic Name: 7,7-dimethyl-1,2-bis(phenylmethyl)-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-ium-5-one Openeye Name: 1,2-dibenzyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-ium-5-one CAS Name: 7,7-dimethyl-1,2-bis(phenylmethyl)-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-ium-5-one IUPAC Name: 1,2-dibenzyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-ium-5-one Traditional Name: 1,2-dibenzyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-ium-5-one Formula: C26H25F6N2O+ MolecularWeight: 495.479919

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(NC(=[N+]2CC3=CC=CC=C3)CC4=CC=CC=C4)(C(F)(F)F)C(F)(F)F)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(NC(=[N+]2CC3=CC=CC=C3)CC4=CC=CC=C4)(C(F)(F)F)C(F)(F)F)C

InChI

InChI=1S/C26H24F6N2O/c1-23(2)14-19-22(20(35)15-23)24(25(27,28)29,26(30,31)32)33-21(13-17-9-5-3-6-10-17)34(19)16-18-11-7-4-8-12-18/h3-12H,13-16H2,1-2H3/p+1