3-azanylidene-1-phenyl-5,6,7,8-tetrahydroisochromene-4-carbonitrile

Systemtic Name: 3-azanylidene-1-phenyl-5,6,7,8-tetrahydroisochromene-4-carbonitrile Openeye Name: 3-imino-1-phenyl-5,6,7,8-tetrahydroisochromene-4-carbonitrile CAS Name: 3-imino-1-phenyl-5,6,7,8-tetrahydro-2-benzopyran-4-carbonitrile IUPAC Name: 3-imino-1-phenyl-5,6,7,8-tetrahydroisochromene-4-carbonitrile Traditional Name: 3-imino-1-phenyl-5,6,7,8-tetrahydroisochromene-4-carbonitrile Formula: C16H14N2O MolecularWeight: 250.29516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(OC(=N)C(=C2C1)C#N)C3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(OC(=N)C(=C2C1)C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O/c17-10-14-12-8-4-5-9-13(12)15(19-16(14)18)11-6-2-1-3-7-11/h1-3,6-7,18H,4-5,8-9H2