4-[(3-bromophenyl)amino]-6-nitro-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-6-nitro-quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6-nitro-quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6-nitro-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-6-nitroquinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6-nitro-quinoline-3-carbonitrile Formula: C16H9BrN4O2 MolecularWeight: 369.17226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=C3C=C(C=CC3=NC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=C3C=C(C=CC3=NC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H9BrN4O2/c17-11-2-1-3-12(6-11)20-16-10(8-18)9-19-15-5-4-13(21(22)23)7-14(15)16/h1-7,9H,(H,19,20)