6-ethyl-2-(3-naphthalen-1-yl-2,1-benzoxazol-5-yl)quinoline-4-carboxylic acid

Systemtic Name: 6-ethyl-2-(3-naphthalen-1-yl-2,1-benzoxazol-5-yl)quinoline-4-carboxylic acid Openeye Name: 6-ethyl-2-[3-(1-naphthyl)-2,1-benzoxazol-5-yl]quinoline-4-carboxylic acid CAS Name: 6-ethyl-2-[3-(1-naphthalenyl)-2,1-benzoxazol-5-yl]-4-quinolinecarboxylic acid IUPAC Name: 6-ethyl-2-(3-naphthalen-1-yl-2,1-benzoxazol-5-yl)quinoline-4-carboxylic acid Traditional Name: 6-ethyl-2-[3-(1-naphthyl)anthranil-5-yl]cinchoninic acid Formula: C29H20N2O3 MolecularWeight: 444.4807

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=C(ON=C4C=C3)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=C(ON=C4C=C3)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H20N2O3/c1-2-17-10-12-25-22(14-17)23(29(32)33)16-27(30-25)19-11-13-26-24(15-19)28(34-31-26)21-9-5-7-18-6-3-4-8-20(18)21/h3-16H,2H2,1H3,(H,32,33)