2-(4-acetamidophenyl)-3-acetyloxy-7,8-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-acetamidophenyl)-3-acetyloxy-7,8-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-acetamidophenyl)-3-acetoxy-7,8-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(4-acetamidophenyl)-3-acetyloxy-7,8-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(4-acetamidophenyl)-3-acetyloxy-7,8-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(4-acetamidophenyl)-3-acetoxy-7,8-dimethyl-cinchoninic acid Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)OC(=O)C)C3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)OC(=O)C)C3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C22H20N2O5/c1-11-5-10-17-18(22(27)28)21(29-14(4)26)20(24-19(17)12(11)2)15-6-8-16(9-7-15)23-13(3)25/h5-10H,1-4H3,(H,23,25)(H,27,28)