methyl 4-[[3-methoxy-4-oxidanyl-6-(quinolin-2-ylmethoxy)-2,4-dihydrochromen-3-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-methoxy-4-oxidanyl-6-(quinolin-2-ylmethoxy)-2,4-dihydrochromen-3-yl]methyl]benzoate Openeye Name: methyl 4-[[4-hydroxy-3-methoxy-6-(2-quinolylmethoxy)chroman-3-yl]methyl]benzoate CAS Name: 4-[[4-hydroxy-3-methoxy-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-hydroxy-3-methoxy-6-(quinolin-2-ylmethoxy)-2,4-dihydrochromen-3-yl]methyl]benzoate Traditional Name: 4-[[4-hydroxy-3-methoxy-6-(2-quinolylmethoxy)chroman-3-yl]methyl]benzoic acid methyl ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC2(COC3=C(C2O)C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC2(COC3=C(C2O)C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)OC

InChI

InChI=1S/C29H27NO6/c1-33-28(32)21-9-7-19(8-10-21)16-29(34-2)18-36-26-14-13-23(15-24(26)27(29)31)35-17-22-12-11-20-5-3-4-6-25(20)30-22/h3-15,27,31H,16-18H2,1-2H3