(1,3-diphenylpyrazol-4-yl)methyl 4-(2-azanyl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 4-(2-azanyl-2-oxidanylidene-ethoxy)benzoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 4-(2-amino-2-oxo-ethoxy)benzoate CAS Name: 4-(2-amino-2-oxoethoxy)benzoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 4-(2-amino-2-oxoethoxy)benzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)benzoic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)C3=CC=C(C=C3)OCC(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)C3=CC=C(C=C3)OCC(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O4/c26-23(29)17-31-22-13-11-19(12-14-22)25(30)32-16-20-15-28(21-9-5-2-6-10-21)27-24(20)18-7-3-1-4-8-18/h1-15H,16-17H2,(H2,26,29)