3-[(E)-3-[4-azanyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-[4-azanyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-(4-amino-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)prop-1-enyl]benzonitrile CAS Name: 3-[(E)-3-(4-amino-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)prop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-3-(4-amino-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)prop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-(4-amino-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)prop-1-enyl]benzonitrile Formula: C18H17N3O2 MolecularWeight: 307.34648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C2C1C(=O)N(C2=O)CC=CC3=CC=CC(=C3)C#N)N

Isomeric SMILES

C1C=CC(C2C1C(=O)N(C2=O)C/C=C/C3=CC=CC(=C3)C#N)N

InChI

InChI=1S/C18H17N3O2/c19-11-13-5-1-4-12(10-13)6-3-9-21-17(22)14-7-2-8-15(20)16(14)18(21)23/h1-6,8,10,14-16H,7,9,20H2/b6-3+