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

Systemtic Name: 6-nitro-2-[(3-propan-2-ylphenyl)amino]quinoline-3-carbonitrile Openeye Name: 2-(3-isopropylanilino)-6-nitro-quinoline-3-carbonitrile CAS Name: 6-nitro-2-(3-propan-2-ylanilino)-3-quinolinecarbonitrile IUPAC Name: 6-nitro-2-(3-propan-2-ylanilino)quinoline-3-carbonitrile Traditional Name: 2-(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=NC3=C(C=C(C=C3)[N+](=O)[O-])C=C2C#N

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C=C2C#N

InChI

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