2-[(E)-2-[4-(dimethylamino)-3-nitro-phenyl]ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[(E)-2-[4-(dimethylamino)-3-nitro-phenyl]ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-[4-(dimethylamino)-3-nitro-phenyl]vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-[4-(dimethylamino)-3-nitrophenyl]ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-[4-(dimethylamino)-3-nitrophenyl]ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-[4-(dimethylamino)-3-nitro-phenyl]vinyl]cinchoninic acid Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C=CC2=NC3=CC=CC=C3C(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O4/c1-22(2)18-10-8-13(11-19(18)23(26)27)7-9-14-12-16(20(24)25)15-5-3-4-6-17(15)21-14/h3-12H,1-2H3,(H,24,25)/b9-7+