3-azanyl-4-(hydroxymethyl)-2-(2-oxidanylidene-3-phenyl-propyl)cyclopent-3-ene-1,1,2-tricarbonitrile

Systemtic Name: 3-azanyl-4-(hydroxymethyl)-2-(2-oxidanylidene-3-phenyl-propyl)cyclopent-3-ene-1,1,2-tricarbonitrile Openeye Name: 3-amino-4-(hydroxymethyl)-2-(2-oxo-3-phenyl-propyl)cyclopent-3-ene-1,1,2-tricarbonitrile CAS Name: 3-amino-4-(hydroxymethyl)-2-(2-oxo-3-phenylpropyl)cyclopent-3-ene-1,1,2-tricarbonitrile IUPAC Name: 3-amino-4-(hydroxymethyl)-2-(2-oxo-3-phenylpropyl)cyclopent-3-ene-1,1,2-tricarbonitrile Traditional Name: 3-amino-2-(2-keto-3-phenyl-propyl)-4-methylol-cyclopent-3-ene-1,1,2-tricarbonitrile Formula: C18H16N4O2 MolecularWeight: 320.34524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C(C1(C#N)C#N)(CC(=O)CC2=CC=CC=C2)C#N)N)CO

Isomeric SMILES

C1C(=C(C(C1(C#N)C#N)(CC(=O)CC2=CC=CC=C2)C#N)N)CO

InChI

InChI=1S/C18H16N4O2/c19-10-17(11-20)7-14(9-23)16(22)18(17,12-21)8-15(24)6-13-4-2-1-3-5-13/h1-5,23H,6-9,22H2