2-[4-[(2S)-4-oxidanylidene-2,3-dihydro-1H-quinazolin-2-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(2S)-4-oxidanylidene-2,3-dihydro-1H-quinazolin-2-yl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(2S)-4-oxo-2,3-dihydro-1H-quinazolin-2-yl]phenoxy]acetonitrile CAS Name: 2-[4-[(2S)-4-oxo-2,3-dihydro-1H-quinazolin-2-yl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(2S)-4-oxo-2,3-dihydro-1H-quinazolin-2-yl]phenoxy]acetonitrile Traditional Name: 2-[4-[(2S)-4-keto-2,3-dihydro-1H-quinazolin-2-yl]phenoxy]acetonitrile Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(N2)C3=CC=C(C=C3)OCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N[C@H](N2)C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C16H13N3O2/c17-9-10-21-12-7-5-11(6-8-12)15-18-14-4-2-1-3-13(14)16(20)19-15/h1-8,15,18H,10H2,(H,19,20)/t15-/m0/s1