3-(diethylaminomethyl)-2,2-dimethyl-4-(3-oxidanylidene-1H-isoindol-2-yl)chromene-6-carbonitrile

Systemtic Name: 3-(diethylaminomethyl)-2,2-dimethyl-4-(3-oxidanylidene-1H-isoindol-2-yl)chromene-6-carbonitrile Openeye Name: 3-(diethylaminomethyl)-2,2-dimethyl-4-(1-oxoisoindolin-2-yl)chromene-6-carbonitrile CAS Name: 3-(diethylaminomethyl)-2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-1-benzopyran-6-carbonitrile IUPAC Name: 3-(diethylaminomethyl)-2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)chromene-6-carbonitrile Traditional Name: 3-(diethylaminomethyl)-4-(1-ketoisoindolin-2-yl)-2,2-dimethyl-chromene-6-carbonitrile Formula: C25H27N3O2 MolecularWeight: 401.50078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CCN(CC)CC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H27N3O2/c1-5-27(6-2)16-21-23(28-15-18-9-7-8-10-19(18)24(28)29)20-13-17(14-26)11-12-22(20)30-25(21,3)4/h7-13H,5-6,15-16H2,1-4H3