(1-azanyl-2-phenyl-ethyl) 4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromene-7-carboxylate

Systemtic Name: (1-azanyl-2-phenyl-ethyl) 4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromene-7-carboxylate Openeye Name: (1-amino-2-phenyl-ethyl) 4-oxo-3-phenoxy-2-(trifluoromethyl)chromene-7-carboxylate CAS Name: 4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-carboxylic acid (1-amino-2-phenylethyl) ester IUPAC Name: (1-amino-2-phenylethyl) 4-oxo-3-phenoxy-2-(trifluoromethyl)chromene-7-carboxylate Traditional Name: 4-keto-3-phenoxy-2-(trifluoromethyl)chromene-7-carboxylic acid (1-amino-2-phenyl-ethyl) ester Formula: C25H18F3NO5 MolecularWeight: 469.40933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(N)OC(=O)C2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(N)OC(=O)C2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4

InChI

InChI=1S/C25H18F3NO5/c26-25(27,28)23-22(32-17-9-5-2-6-10-17)21(30)18-12-11-16(14-19(18)33-23)24(31)34-20(29)13-15-7-3-1-4-8-15/h1-12,14,20H,13,29H2