2-[4-[(2S)-4-oxidanylidene-3-propyl-1,2-dihydroquinazolin-2-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(2S)-4-oxidanylidene-3-propyl-1,2-dihydroquinazolin-2-yl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(2S)-4-oxo-3-propyl-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile CAS Name: 2-[4-[(2S)-4-oxo-3-propyl-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(2S)-4-oxo-3-propyl-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile Traditional Name: 2-[4-[(2S)-4-keto-3-propyl-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(NC2=CC=CC=C2C1=O)C3=CC=C(C=C3)OCC#N

Isomeric SMILES

CCCN1[C@H](NC2=CC=CC=C2C1=O)C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C19H19N3O2/c1-2-12-22-18(14-7-9-15(10-8-14)24-13-11-20)21-17-6-4-3-5-16(17)19(22)23/h3-10,18,21H,2,12-13H2,1H3/t18-/m0/s1