methyl 3-[2-[3-(2-naphthalen-2-yloxyethanoylamino)phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-(2-naphthalen-2-yloxyethanoylamino)phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[[2-(2-naphthyloxy)acetyl]amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[2-(2-naphthalenyloxy)-1-oxoethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[[2-(2-naphthoxy)acetyl]amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C28H21NO4 MolecularWeight: 435.47064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C#CC2=CC(=CC=C2)NC(=O)COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C#CC2=CC(=CC=C2)NC(=O)COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H21NO4/c1-32-28(31)24-10-4-6-20(16-24)12-13-21-7-5-11-25(17-21)29-27(30)19-33-26-15-14-22-8-2-3-9-23(22)18-26/h2-11,14-18H,19H2,1H3,(H,29,30)