4-[3-[(E)-[1-(phenylmethyl)indol-2-yl]methylideneamino]oxypropoxy]-3-[4-(trifluoromethyl)phenyl]benzoic acid

Systemtic Name: 4-[3-[(E)-[1-(phenylmethyl)indol-2-yl]methylideneamino]oxypropoxy]-3-[4-(trifluoromethyl)phenyl]benzoic acid Openeye Name: 4-[3-[(E)-(1-benzylindol-2-yl)methyleneamino]oxypropoxy]-3-[4-(trifluoromethyl)phenyl]benzoic acid CAS Name: 4-[3-[(E)-[1-(phenylmethyl)-2-indolyl]methylideneamino]oxypropoxy]-3-[4-(trifluoromethyl)phenyl]benzoic acid IUPAC Name: 4-[3-[(E)-(1-benzylindol-2-yl)methylideneamino]oxypropoxy]-3-[4-(trifluoromethyl)phenyl]benzoic acid Traditional Name: 4-[3-[(E)-(1-benzylindol-2-yl)methyleneamino]oxypropoxy]-3-[4-(trifluoromethyl)phenyl]benzoic acid Formula: C33H27F3N2O4 MolecularWeight: 572.57369

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C=C2C=NOCCCOC4=C(C=C(C=C4)C(=O)O)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C=C2/C=N/OCCCOC4=C(C=C(C=C4)C(=O)O)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C33H27F3N2O4/c34-33(35,36)27-14-11-24(12-15-27)29-20-26(32(39)40)13-16-31(29)41-17-6-18-42-37-21-28-19-25-9-4-5-10-30(25)38(28)22-23-7-2-1-3-8-23/h1-5,7-16,19-21H,6,17-18,22H2,(H,39,40)/b37-21+