2-(12-oxidanylidene-6H-indolo[2,1-c][1,4]benzodiazepin-11-yl)ethanenitrile

Systemtic Name: 2-(12-oxidanylidene-6H-indolo[2,1-c][1,4]benzodiazepin-11-yl)ethanenitrile Openeye Name: 2-(12-oxo-6H-indolo[2,1-c][1,4]benzodiazepin-11-yl)acetonitrile CAS Name: 2-(12-oxo-6H-indolo[2,1-c][1,4]benzodiazepin-11-yl)acetonitrile IUPAC Name: 2-(12-oxo-6H-indolo[2,1-c][1,4]benzodiazepin-11-yl)acetonitrile Traditional Name: 2-(12-keto-6H-indolo[2,1-c][1,4]benzodiazepin-11-yl)acetonitrile Formula: C18H13N3O MolecularWeight: 287.31532

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N(C(=O)C3=CC4=CC=CC=C4N31)CC#N

Isomeric SMILES

C1C2=CC=CC=C2N(C(=O)C3=CC4=CC=CC=C4N31)CC#N

InChI

InChI=1S/C18H13N3O/c19-9-10-20-16-8-4-2-6-14(16)12-21-15-7-3-1-5-13(15)11-17(21)18(20)22/h1-8,11H,10,12H2