[bis(phenylmethyl)amino] tris(fluoranyl)methanesulfonate; 3,4-dihydro-2H-chromene

Systemtic Name: [bis(phenylmethyl)amino] tris(fluoranyl)methanesulfonate; 3,4-dihydro-2H-chromene Openeye Name: chromane; (dibenzylamino) trifluoromethanesulfonate CAS Name: 3,4-dihydro-2H-1-benzopyran; trifluoromethanesulfonic acid [bis(phenylmethyl)amino] ester IUPAC Name: (dibenzylamino) trifluoromethanesulfonate; 3,4-dihydro-2H-chromene Traditional Name: chroman; trifluoromethanesulfonic acid (dibenzylamino) ester Formula: C24H24F3NO4S MolecularWeight: 479.51187

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2OC1.C1=CC=C(C=C1)CN(CC2=CC=CC=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1CC2=CC=CC=C2OC1.C1=CC=C(C=C1)CN(CC2=CC=CC=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C15H14F3NO3S.C9H10O/c16-15(17,18)23(20,21)22-19(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14;1-2-6-9-8(4-1)5-3-7-10-9/h1-10H,11-12H2;1-2,4,6H,3,5,7H2