bis(3-ethynylphenyl) 5-azanylbenzene-1,3-dicarboxylate

Systemtic Name: bis(3-ethynylphenyl) 5-azanylbenzene-1,3-dicarboxylate Openeye Name: bis(3-ethynylphenyl) 5-aminobenzene-1,3-dicarboxylate CAS Name: 5-aminobenzene-1,3-dicarboxylic acid bis(3-ethynylphenyl) ester IUPAC Name: bis(3-ethynylphenyl) 5-aminobenzene-1,3-dicarboxylate Traditional Name: 5-aminobenzene-1,3-dicarboxylic acid bis(3-ethynylphenyl) ester Formula: C24H15NO4 MolecularWeight: 381.3802

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OC(=O)C2=CC(=CC(=C2)N)C(=O)OC3=CC=CC(=C3)C#C

Isomeric SMILES

C#CC1=CC(=CC=C1)OC(=O)C2=CC(=CC(=C2)N)C(=O)OC3=CC=CC(=C3)C#C

InChI

InChI=1S/C24H15NO4/c1-3-16-7-5-9-21(11-16)28-23(26)18-13-19(15-20(25)14-18)24(27)29-22-10-6-8-17(4-2)12-22/h1-2,5-15H,25H2