4-[3-(imidazol-1-ylmethyl)-4-oxidanylidene-chromen-2-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(imidazol-1-ylmethyl)-4-oxidanylidene-chromen-2-yl]benzenecarbonitrile Openeye Name: 4-[3-(imidazol-1-ylmethyl)-4-oxo-chromen-2-yl]benzonitrile CAS Name: 4-[3-(1-imidazolylmethyl)-4-oxo-1-benzopyran-2-yl]benzonitrile IUPAC Name: 4-[3-(imidazol-1-ylmethyl)-4-oxochromen-2-yl]benzonitrile Traditional Name: 4-[3-(imidazol-1-ylmethyl)-4-keto-chromen-2-yl]benzonitrile Formula: C20H13N3O2 MolecularWeight: 327.33612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C#N)CN4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C#N)CN4C=CN=C4

InChI

InChI=1S/C20H13N3O2/c21-11-14-5-7-15(8-6-14)20-17(12-23-10-9-22-13-23)19(24)16-3-1-2-4-18(16)25-20/h1-10,13H,12H2