4-[(3-azanyl-4-bromanyl-2-oxidanylidene-3H-indol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(3-azanyl-4-bromanyl-2-oxidanylidene-3H-indol-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(3-amino-4-bromo-2-oxo-indolin-1-yl)methyl]benzonitrile CAS Name: 4-[(3-amino-4-bromo-2-oxo-3H-indol-1-yl)methyl]benzonitrile IUPAC Name: 4-[(3-amino-4-bromo-2-oxo-3H-indol-1-yl)methyl]benzonitrile Traditional Name: 4-[(3-amino-4-bromo-2-keto-indolin-1-yl)methyl]benzonitrile Formula: C16H12BrN3O MolecularWeight: 342.18998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(C(=O)N2CC3=CC=C(C=C3)C#N)N)C(=C1)Br

Isomeric SMILES

C1=CC2=C(C(C(=O)N2CC3=CC=C(C=C3)C#N)N)C(=C1)Br

InChI

InChI=1S/C16H12BrN3O/c17-12-2-1-3-13-14(12)15(19)16(21)20(13)9-11-6-4-10(8-18)5-7-11/h1-7,15H,9,19H2