6-methyl-2-(3-propoxyphenyl)quinoline-4-carboxylate

Systemtic Name: 6-methyl-2-(3-propoxyphenyl)quinoline-4-carboxylate Openeye Name: 6-methyl-2-(3-propoxyphenyl)quinoline-4-carboxylate CAS Name: 6-methyl-2-(3-propoxyphenyl)-4-quinolinecarboxylate IUPAC Name: 6-methyl-2-(3-propoxyphenyl)quinoline-4-carboxylate Traditional Name: 6-methyl-2-(3-propoxyphenyl)cinchoninate Formula: C20H18NO3- MolecularWeight: 320.36182

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)[O-]

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)[O-]

InChI

InChI=1S/C20H19NO3/c1-3-9-24-15-6-4-5-14(11-15)19-12-17(20(22)23)16-10-13(2)7-8-18(16)21-19/h4-8,10-12H,3,9H2,1-2H3,(H,22,23)/p-1