4-[[(2E)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]oxy]benzenecarbonitrile

Systemtic Name: 4-[[(2E)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]oxy]benzenecarbonitrile Openeye Name: 4-[[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]oxy]benzonitrile CAS Name: 4-[[(2E)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-yl]oxy]benzonitrile IUPAC Name: 4-[[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]oxy]benzonitrile Traditional Name: 4-[[(2E)-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]oxy]benzonitrile Formula: C21H13N3O2 MolecularWeight: 339.34682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=C3C=CC=CC3=O)N2)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=N/C(=C/3\C=CC=CC3=O)/N2)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H13N3O2/c22-13-14-9-11-15(12-10-14)26-21-16-5-1-3-7-18(16)23-20(24-21)17-6-2-4-8-19(17)25/h1-12,23H/b20-17+