3-[(3-oxidanylidene-1-prop-2-enyl-2-benzofuran-1-yl)methylamino]propanenitrile

Systemtic Name: 3-[(3-oxidanylidene-1-prop-2-enyl-2-benzofuran-1-yl)methylamino]propanenitrile Openeye Name: 3-[(1-allyl-3-oxo-isobenzofuran-1-yl)methylamino]propanenitrile CAS Name: 3-[(3-oxo-1-prop-2-enyl-1-isobenzofuranyl)methylamino]propanenitrile IUPAC Name: 3-[(3-oxo-1-prop-2-enyl-2-benzofuran-1-yl)methylamino]propanenitrile Traditional Name: 3-[(1-allyl-3-keto-phthalan-1-yl)methylamino]propionitrile Formula: C15H16N2O2 MolecularWeight: 256.29974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C2=CC=CC=C2C(=O)O1)CNCCC#N

Isomeric SMILES

C=CCC1(C2=CC=CC=C2C(=O)O1)CNCCC#N

InChI

InChI=1S/C15H16N2O2/c1-2-8-15(11-17-10-5-9-16)13-7-4-3-6-12(13)14(18)19-15/h2-4,6-7,17H,1,5,8,10-11H2