methyl 3-[2-[3-[(4-propan-2-yloxyphenyl)carbonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(4-propan-2-yloxyphenyl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(4-isopropoxybenzoyl)amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(4-propan-2-yloxybenzoyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(4-isopropoxybenzoyl)amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C26H23NO4 MolecularWeight: 413.46512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C26H23NO4/c1-18(2)31-24-14-12-21(13-15-24)25(28)27-23-9-5-7-20(17-23)11-10-19-6-4-8-22(16-19)26(29)30-3/h4-9,12-18H,1-3H3,(H,27,28)