2-methyl-6,7-bis(phenylmethoxy)quinoline-4-carboxylic acid

Systemtic Name: 2-methyl-6,7-bis(phenylmethoxy)quinoline-4-carboxylic acid Openeye Name: 6,7-dibenzyloxy-2-methyl-quinoline-4-carboxylic acid CAS Name: 2-methyl-6,7-bis(phenylmethoxy)-4-quinolinecarboxylic acid IUPAC Name: 2-methyl-6,7-bis(phenylmethoxy)quinoline-4-carboxylic acid Traditional Name: 6,7-dibenzoxy-2-methyl-cinchoninic acid Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2C(=C1)C(=O)O)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC(=C(C=C2C(=C1)C(=O)O)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H21NO4/c1-17-12-21(25(27)28)20-13-23(29-15-18-8-4-2-5-9-18)24(14-22(20)26-17)30-16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,27,28)