6-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-isopropylphenyl)-6-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]quinoline-4-carboxamide CAS Name: 6-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-propan-2-ylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Traditional Name: 6-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-p-cumenyl-cinchoninamide Formula: C28H24N4O5 MolecularWeight: 496.51396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NN=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C5=CC=C(C=C5)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N/N=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4)C5=CC=C(C=C5)C(C)C

InChI

InChI=1S/C28H24N4O5/c1-16(2)18-5-7-19(8-6-18)24-12-22(21-10-17(3)4-9-23(21)30-24)28(33)31-29-14-20-11-26-27(37-15-36-26)13-25(20)32(34)35/h4-14,16H,15H2,1-3H3,(H,31,33)/b29-14+