sodium 2-phenylmethoxy-3-[2-[(4-phenylmethoxyphenyl)methyl]-3,4-dihydro-2H-chromen-6-yl]propanoate

Systemtic Name: sodium 2-phenylmethoxy-3-[2-[(4-phenylmethoxyphenyl)methyl]-3,4-dihydro-2H-chromen-6-yl]propanoate Openeye Name: sodium 2-benzyloxy-3-[2-[(4-benzyloxyphenyl)methyl]chroman-6-yl]propanoate CAS Name: sodium 2-phenylmethoxy-3-[2-[(4-phenylmethoxyphenyl)methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]propanoate IUPAC Name: sodium 2-phenylmethoxy-3-[2-[(4-phenylmethoxyphenyl)methyl]-3,4-dihydro-2H-chromen-6-yl]propanoate Traditional Name: sodium 2-benzoxy-3-[2-(4-benzoxybenzyl)chroman-6-yl]propionate Formula: C33H31NaO5 MolecularWeight: 530.58601

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)CC(C(=O)[O-])OCC3=CC=CC=C3)OC1CC4=CC=C(C=C4)OCC5=CC=CC=C5.[Na+]

Isomeric SMILES

C1CC2=C(C=CC(=C2)CC(C(=O)[O-])OCC3=CC=CC=C3)OC1CC4=CC=C(C=C4)OCC5=CC=CC=C5.[Na+]

InChI

InChI=1S/C33H32O5.Na/c34-33(35)32(37-23-26-9-5-2-6-10-26)21-27-13-18-31-28(19-27)14-17-30(38-31)20-24-11-15-29(16-12-24)36-22-25-7-3-1-4-8-25;/h1-13,15-16,18-19,30,32H,14,17,20-23H2,(H,34,35);/q;+1/p-1