[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 3-fluoranylbenzoate

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 3-fluoranylbenzoate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C24H22FNO3 MolecularWeight: 391.434783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC(=O)COC(=O)C2=CC(=CC=C2)F)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC(=O)COC(=O)C2=CC(=CC=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C24H22FNO3/c25-21-13-7-12-20(16-21)24(28)29-17-23(27)26-15-14-22(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-13,16,22H,14-15,17H2,(H,26,27)