(8S)-6-azanyl-8-(5-methylfuran-2-yl)-1,3,8,8a-tetrahydroisochromene-5,7,7-tricarbonitrile

Systemtic Name: (8S)-6-azanyl-8-(5-methylfuran-2-yl)-1,3,8,8a-tetrahydroisochromene-5,7,7-tricarbonitrile Openeye Name: (8S)-6-amino-8-(5-methyl-2-furyl)-1,3,8,8a-tetrahydroisochromene-5,7,7-tricarbonitrile CAS Name: (8S)-6-amino-8-(5-methyl-2-furanyl)-1,3,8,8a-tetrahydro-2-benzopyran-5,7,7-tricarbonitrile IUPAC Name: (8S)-6-amino-8-(5-methylfuran-2-yl)-1,3,8,8a-tetrahydroisochromene-5,7,7-tricarbonitrile Traditional Name: (8S)-6-amino-8-(5-methyl-2-furyl)-1,3,8,8a-tetrahydroisochromene-5,7,7-tricarbonitrile Formula: C17H14N4O2 MolecularWeight: 306.31866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2C3COCC=C3C(=C(C2(C#N)C#N)N)C#N

Isomeric SMILES

CC1=CC=C(O1)[C@H]2C3COCC=C3C(=C(C2(C#N)C#N)N)C#N

InChI

InChI=1S/C17H14N4O2/c1-10-2-3-14(23-10)15-13-7-22-5-4-11(13)12(6-18)16(21)17(15,8-19)9-20/h2-4,13,15H,5,7,21H2,1H3/t13?,15-/m1/s1