2-(1-prop-2-enylindol-3-yl)-2-[[3-(trifluoromethyl)phenyl]methylamino]ethanoic acid

Systemtic Name: 2-(1-prop-2-enylindol-3-yl)-2-[[3-(trifluoromethyl)phenyl]methylamino]ethanoic acid Openeye Name: 2-(1-allylindol-3-yl)-2-[[3-(trifluoromethyl)phenyl]methylamino]acetic acid CAS Name: 2-(1-prop-2-enyl-3-indolyl)-2-[[3-(trifluoromethyl)phenyl]methylamino]acetic acid IUPAC Name: 2-(1-prop-2-enylindol-3-yl)-2-[[3-(trifluoromethyl)phenyl]methylamino]acetic acid Traditional Name: 2-(1-allylindol-3-yl)-2-[[3-(trifluoromethyl)benzyl]amino]acetic acid Formula: C21H19F3N2O2 MolecularWeight: 388.38297

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=C(C2=CC=CC=C21)C(C(=O)O)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C=CCN1C=C(C2=CC=CC=C21)C(C(=O)O)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H19F3N2O2/c1-2-10-26-13-17(16-8-3-4-9-18(16)26)19(20(27)28)25-12-14-6-5-7-15(11-14)21(22,23)24/h2-9,11,13,19,25H,1,10,12H2,(H,27,28)