methyl 3-methyl-2-oxidanylidene-3-pyridin-2-yl-6-(quinolin-2-ylmethoxy)-4H-chromene-4-carboxylate

Systemtic Name: methyl 3-methyl-2-oxidanylidene-3-pyridin-2-yl-6-(quinolin-2-ylmethoxy)-4H-chromene-4-carboxylate Openeye Name: methyl 3-methyl-2-oxo-3-(2-pyridyl)-6-(2-quinolylmethoxy)chromane-4-carboxylate CAS Name: 3-methyl-2-oxo-3-(2-pyridinyl)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-oxo-3-pyridin-2-yl-6-(quinolin-2-ylmethoxy)-4H-chromene-4-carboxylate Traditional Name: 2-keto-3-methyl-3-(2-pyridyl)-6-(2-quinolylmethoxy)chroman-4-carboxylic acid methyl ester Formula: C27H22N2O5 MolecularWeight: 454.47398

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=C(C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)OC1=O)C(=O)OC)C5=CC=CC=N5

Isomeric SMILES

CC1(C(C2=C(C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)OC1=O)C(=O)OC)C5=CC=CC=N5

InChI

InChI=1S/C27H22N2O5/c1-27(23-9-5-6-14-28-23)24(25(30)32-2)20-15-19(12-13-22(20)34-26(27)31)33-16-18-11-10-17-7-3-4-8-21(17)29-18/h3-15,24H,16H2,1-2H3