4-[(3-bromophenyl)amino]-6-(2-methanoylpyrrol-1-yl)quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-6-(2-methanoylpyrrol-1-yl)quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6-(2-formylpyrrol-1-yl)quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6-(2-formyl-1-pyrrolyl)-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-6-(2-formylpyrrol-1-yl)quinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6-(2-formylpyrrol-1-yl)quinoline-3-carbonitrile Formula: C21H13BrN4O MolecularWeight: 417.25812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=C3C=C(C=CC3=NC=C2C#N)N4C=CC=C4C=O

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=C3C=C(C=CC3=NC=C2C#N)N4C=CC=C4C=O

InChI

InChI=1S/C21H13BrN4O/c22-15-3-1-4-16(9-15)25-21-14(11-23)12-24-20-7-6-17(10-19(20)21)26-8-2-5-18(26)13-27/h1-10,12-13H,(H,24,25)