6-nitro-4-[(3-propan-2-ylphenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 6-nitro-4-[(3-propan-2-ylphenyl)amino]quinoline-3-carbonitrile Openeye Name: 4-(3-isopropylanilino)-6-nitro-quinoline-3-carbonitrile CAS Name: 6-nitro-4-(3-propan-2-ylanilino)-3-quinolinecarbonitrile IUPAC Name: 6-nitro-4-(3-propan-2-ylanilino)quinoline-3-carbonitrile Traditional Name: 4-(3-isopropylanilino)-6-nitro-quinoline-3-carbonitrile Formula: C19H16N4O2 MolecularWeight: 332.35594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4O2/c1-12(2)13-4-3-5-15(8-13)22-19-14(10-20)11-21-18-7-6-16(23(24)25)9-17(18)19/h3-9,11-12H,1-2H3,(H,21,22)