[4-[2-cyano-3-oxidanylidene-3-(quinolin-5-ylamino)prop-1-enyl]phenyl] benzoate

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-(quinolin-5-ylamino)prop-1-enyl]phenyl] benzoate Openeye Name: [4-[2-cyano-3-oxo-3-(5-quinolylamino)prop-1-enyl]phenyl] benzoate CAS Name: benzoic acid [4-[2-cyano-3-oxo-3-(5-quinolinylamino)prop-1-enyl]phenyl] ester IUPAC Name: [4-[2-cyano-3-oxo-3-(quinolin-5-ylamino)prop-1-enyl]phenyl] benzoate Traditional Name: benzoic acid [4-[2-cyano-3-keto-3-(5-quinolylamino)prop-1-enyl]phenyl] ester Formula: C26H17N3O3 MolecularWeight: 419.43148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C26H17N3O3/c27-17-20(25(30)29-24-10-4-9-23-22(24)8-5-15-28-23)16-18-11-13-21(14-12-18)32-26(31)19-6-2-1-3-7-19/h1-16H,(H,29,30)