2-azanyl-4-bromanyl-quinoline-3-carbonitrile; 2-azanyl-4-oxidanylidene-1H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-bromanyl-quinoline-3-carbonitrile; 2-azanyl-4-oxidanylidene-1H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-bromo-quinoline-3-carbonitrile; 2-amino-4-oxo-1H-quinoline-3-carbonitrile CAS Name: 2-amino-4-bromo-3-quinolinecarbonitrile; 2-amino-4-oxo-1H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-bromoquinoline-3-carbonitrile; 2-amino-4-oxo-1H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-bromo-quinoline-3-carbonitrile; 2-amino-4-keto-1H-quinoline-3-carbonitrile Formula: C20H13BrN6O MolecularWeight: 433.26082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(N2)N)C#N.C1=CC=C2C(=C1)C(=C(C(=N2)N)C#N)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(N2)N)C#N.C1=CC=C2C(=C1)C(=C(C(=N2)N)C#N)Br

InChI

InChI=1S/C10H6BrN3.C10H7N3O/c11-9-6-3-1-2-4-8(6)14-10(13)7(9)5-12;11-5-7-9(14)6-3-1-2-4-8(6)13-10(7)12/h1-4H,(H2,13,14);1-4H,(H3,12,13,14)