methyl 3-[(4-oxidanyl-6-quinolin-2-yloxy-3,4-dihydro-2H-chromen-3-yl)methyl]benzoate

Systemtic Name: methyl 3-[(4-oxidanyl-6-quinolin-2-yloxy-3,4-dihydro-2H-chromen-3-yl)methyl]benzoate Openeye Name: methyl 3-[[4-hydroxy-6-(2-quinolyloxy)chroman-3-yl]methyl]benzoate CAS Name: 3-[[4-hydroxy-6-(2-quinolinyloxy)-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-hydroxy-6-quinolin-2-yloxy-3,4-dihydro-2H-chromen-3-yl)methyl]benzoate Traditional Name: 3-[[4-hydroxy-6-(2-quinolyloxy)chroman-3-yl]methyl]benzoic acid methyl ester Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CC2COC3=C(C2O)C=C(C=C3)OC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CC2COC3=C(C2O)C=C(C=C3)OC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H23NO5/c1-31-27(30)19-7-4-5-17(13-19)14-20-16-32-24-11-10-21(15-22(24)26(20)29)33-25-12-9-18-6-2-3-8-23(18)28-25/h2-13,15,20,26,29H,14,16H2,1H3