tert-butyl 4-(3-fluorophenyl)-2-(4-methoxyphenyl)imino-but-3-ynoate

Systemtic Name: tert-butyl 4-(3-fluorophenyl)-2-(4-methoxyphenyl)imino-but-3-ynoate Openeye Name: tert-butyl 4-(3-fluorophenyl)-2-(4-methoxyphenyl)imino-but-3-ynoate CAS Name: 4-(3-fluorophenyl)-2-(4-methoxyphenyl)imino-3-butynoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-fluorophenyl)-2-(4-methoxyphenyl)iminobut-3-ynoate Traditional Name: 4-(3-fluorophenyl)-2-(4-methoxyphenyl)imino-but-3-ynoic acid tert-butyl ester Formula: C21H20FNO3 MolecularWeight: 353.386803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=NC1=CC=C(C=C1)OC)C#CC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)C(=NC1=CC=C(C=C1)OC)C#CC2=CC(=CC=C2)F

InChI

InChI=1S/C21H20FNO3/c1-21(2,3)26-20(24)19(13-8-15-6-5-7-16(22)14-15)23-17-9-11-18(25-4)12-10-17/h5-7,9-12,14H,1-4H3