3-[(3-azanyl-5,6,7,8-tetrahydrobenzo[f][1]benzofuran-2-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 3-[(3-azanyl-5,6,7,8-tetrahydrobenzo[f][1]benzofuran-2-yl)carbonyl]benzenecarbonitrile Openeye Name: 3-(3-amino-5,6,7,8-tetrahydrobenzo[f]benzofuran-2-carbonyl)benzonitrile CAS Name: 3-[(3-amino-5,6,7,8-tetrahydrobenzo[f]benzofuran-2-yl)-oxomethyl]benzonitrile IUPAC Name: 3-(3-amino-5,6,7,8-tetrahydrobenzo[f][1]benzofuran-2-carbonyl)benzonitrile Traditional Name: 3-(3-amino-5,6,7,8-tetrahydrobenzo[f]benzofuran-2-carbonyl)benzonitrile Formula: C20H16N2O2 MolecularWeight: 316.35324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C3C(=C2)OC(=C3N)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C=C3C(=C2)OC(=C3N)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H16N2O2/c21-11-12-4-3-7-15(8-12)19(23)20-18(22)16-9-13-5-1-2-6-14(13)10-17(16)24-20/h3-4,7-10H,1-2,5-6,22H2