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

Systemtic Name: methyl 3-[2-[3-[(4-dimethylaminophenyl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[[4-(dimethylamino)benzoyl]amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[(4-dimethylaminophenyl)-oxomethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[[4-(dimethylamino)benzoyl]amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[[4-(dimethylamino)benzoyl]amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N2O3/c1-27(2)23-14-12-20(13-15-23)24(28)26-22-9-5-7-19(17-22)11-10-18-6-4-8-21(16-18)25(29)30-3/h4-9,12-17H,1-3H3,(H,26,28)