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

Systemtic Name: methyl 2-methylidene-4-oxidanylidene-3-pyridin-2-yl-6-(quinolin-2-ylmethoxy)chromene-3-carboxylate Openeye Name: methyl 2-methylene-4-oxo-3-(2-pyridyl)-6-(2-quinolylmethoxy)chromane-3-carboxylate CAS Name: 2-methylene-4-oxo-3-(2-pyridinyl)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methylidene-4-oxo-3-pyridin-2-yl-6-(quinolin-2-ylmethoxy)chromene-3-carboxylate Traditional Name: 4-keto-2-methylene-3-(2-pyridyl)-6-(2-quinolylmethoxy)chroman-3-carboxylic acid methyl ester Formula: C27H20N2O5 MolecularWeight: 452.4581

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(=C)OC2=C(C1=O)C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C5=CC=CC=N5

Isomeric SMILES

COC(=O)C1(C(=C)OC2=C(C1=O)C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C5=CC=CC=N5

InChI

InChI=1S/C27H20N2O5/c1-17-27(26(31)32-2,24-9-5-6-14-28-24)25(30)21-15-20(12-13-23(21)34-17)33-16-19-11-10-18-7-3-4-8-22(18)29-19/h3-15H,1,16H2,2H3