4-oxidanyl-3-(phenylmethoxymethyl)-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate

Systemtic Name: 4-oxidanyl-3-(phenylmethoxymethyl)-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate Openeye Name: 3-(benzyloxymethyl)-4-hydroxy-1-(3,4,5-trimethoxyphenyl)tetralin-2-carboxylate CAS Name: 4-hydroxy-3-(phenylmethoxymethyl)-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate IUPAC Name: 4-hydroxy-3-(phenylmethoxymethyl)-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate Traditional Name: 3-(benzoxymethyl)-4-hydroxy-1-(3,4,5-trimethoxyphenyl)tetralin-2-carboxylate Formula: C28H29O7- MolecularWeight: 477.52566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC=CC=C23)O)COCC4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC=CC=C23)O)COCC4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C28H30O7/c1-32-22-13-18(14-23(33-2)27(22)34-3)24-19-11-7-8-12-20(19)26(29)21(25(24)28(30)31)16-35-15-17-9-5-4-6-10-17/h4-14,21,24-26,29H,15-16H2,1-3H3,(H,30,31)/p-1