(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-methylquinoline-4-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-methylquinoline-4-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H17NO4 MolecularWeight: 395.40678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C25H17NO4/c1-15-12-20(19-8-4-5-9-21(19)26-15)25(28)29-14-17-13-23(27)30-22-11-10-16-6-2-3-7-18(16)24(17)22/h2-13H,14H2,1H3