[2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: [2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] 4-(2-cyanoethanoylamino)benzoate Openeye Name: [2-(9H-fluoren-3-yl)-2-oxo-ethyl] 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid [2-(9H-fluoren-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(9H-fluoren-3-yl)-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid [2-(9H-fluoren-3-yl)-2-keto-ethyl] ester Formula: C25H18N2O4 MolecularWeight: 410.42142

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)NC(=O)CC#N)C4=CC=CC=C41

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)NC(=O)CC#N)C4=CC=CC=C41

InChI

InChI=1S/C25H18N2O4/c26-12-11-24(29)27-20-9-7-16(8-10-20)25(30)31-15-23(28)19-6-5-18-13-17-3-1-2-4-21(17)22(18)14-19/h1-10,14H,11,13,15H2,(H,27,29)