(6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-methylquinoline-4-carboxylate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-methylquinoline-4-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C19H14BrNO4 MolecularWeight: 400.22276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC4=C(C=C3Br)OCO4

InChI

InChI=1S/C19H14BrNO4/c1-11-6-14(13-4-2-3-5-16(13)21-11)19(22)23-9-12-7-17-18(8-15(12)20)25-10-24-17/h2-8H,9-10H2,1H3